Naphthalene, 2-methyl-

Formula: C₁₁H₁₀
Molecular weight: 142.1971
IUPAC Standard InChI: InChI=1S/C11H10/c1-9-6-7-10-4-2-3-5-11(10)8-9/h2-8H,1H3
IUPAC Standard InChIKey: QIMMUPPBPVKWKM-UHFFFAOYSA-N
CAS Registry Number: 91-57-6
Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript.
Other names: β-Methylnaphthalene; 2-Methylnaphthalene; 2-methyInaphthalene; Methyl-2-naphthalene
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Information on this page:
Other data available:
Data at other public NIST sites:
- Gas Phase Kinetics Database
- NIST Polycyclic Aromatic Hydrocarbon Structure Index
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Gas phase thermochemistry data

Go To: Top, Condensed phase thermochemistry data, Phase change data, Henry's Law data, Gas Chromatography, References, Notes

Data compiled as indicated in comments:
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DRB - Donald R. Burgess, Jr.
GT - Glushko Thermocenter, Russian Academy of Sciences, Moscow

Quantity	Value	Units	Method	Reference	Comment
Δ_fH°_gas	116.1 ± 2.6	kJ/mol	Ccb	Speros and Rossini, 1960	Hfusion=2.83±0.01; ALS
Δ_fH°_gas	106.2	kJ/mol	N/A	Richardson and Parks, 1939	Value computed using Δ_fH_solid° value of 35.0±2.2 kj/mol from Richardson and Parks, 1939 and Δ_subH° value of 71.2 kj/mol from Richardson and Parks, 1939.; DRB

Constant pressure heat capacity of gas

C_p,gas (J/mol*K)	Temperature (K)	Reference	Comment
43.3	50.	Thermodynamics Research Center, 1997	p=1 bar.; GT
61.9	100.
80.8	150.
103.2	200.
141.1	273.15
154.6	298.15
155.6	300.
207.7	400.
252.2	500.
288.5	600.
318.0	700.
342.3	800.
362.5	900.
379.4	1000.
394.	1100.
406.	1200.
417.	1300.
426.	1400.
433.	1500.

Condensed phase thermochemistry data

Go To: Top, Gas phase thermochemistry data, Phase change data, Henry's Law data, Gas Chromatography, References, Notes

Data compiled as indicated in comments:
DH - Eugene S. Domalski and Elizabeth D. Hearing
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein

Quantity	Value	Units	Method	Reference	Comment
S°_liquid	219.99	J/mol*K	N/A	McCullough, Finke, et al., 1957	DH
S°_liquid	203.8	J/mol*K	N/A	Huffman, Parks, et al., 1931	Extrapolation below 90 K, 65.86 J/molK. Value is for crystal. Did not observe transition at 288 K with S= 19.2 J/molK.; DH
Quantity	Value	Units	Method	Reference	Comment
Δ_fH°_solid	44.9 ± 1.5	kJ/mol	Ccb	Speros and Rossini, 1960	Hfusion=2.83±0.01; ALS
Δ_fH°_solid	35.0 ± 2.2	kJ/mol	Ccb	Richardson and Parks, 1939	Reanalyzed by Cox and Pilcher, 1970, Original value = 33.4 kJ/mol; see Richardson, 1939; ALS
Quantity	Value	Units	Method	Reference	Comment
Δ_cH°_solid	-5802.7 ± 1.5	kJ/mol	Ccb	Speros and Rossini, 1960	Hfusion=2.83±0.01; Corresponding Δ_fHº_solid = 44.94 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS
Δ_cH°_solid	-5792.7 ± 2.2	kJ/mol	Ccb	Richardson and Parks, 1939	Reanalyzed by Cox and Pilcher, 1970, Original value = -5790.28 kJ/mol; see Richardson, 1939; Corresponding Δ_fHº_solid = 35.0 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS

Constant pressure heat capacity of liquid

C_p,liquid (J/mol*K)	Temperature (K)	Reference	Comment
195.98	298.15	McCullough, Finke, et al., 1957	T = 10 to 400 K.; DH
228.0	310.4	Huffman, Parks, et al., 1931	T = 94 to 310 K. Value is unsmoothed experimental datum.; DH

Phase change data

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Henry's Law data, Gas Chromatography, References, Notes

Data compiled as indicated in comments:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos
DRB - Donald R. Burgess, Jr.
DH - Eugene S. Domalski and Elizabeth D. Hearing
CAL - James S. Chickos, William E. Acree, Jr., Joel F. Liebman, Students of Chem 202 (Introduction to the Literature of Chemistry), University of Missouri -- St. Louis

Quantity	Value	Units	Method	Reference	Comment
T_boil	514. ± 1.	K	AVG	N/A	Average of 15 out of 16 values; Individual data points
Quantity	Value	Units	Method	Reference	Comment
T_fus	307. ± 1.	K	AVG	N/A	Average of 15 out of 16 values; Individual data points
Quantity	Value	Units	Method	Reference	Comment
T_triple	307.7200	K	N/A	McCullough, Finke, et al., 1957, 2	Crystal phase 1 phase; Uncertainty assigned by TRC = 0.08 K; TRC
T_triple	307.7200	K	N/A	McCullough, Finke, et al., 1957, 2	Crystal phase 1 phase; Uncertainty assigned by TRC = 0.05 K; TRC
T_triple	307.2	K	N/A	Huffman, Parks, et al., 1931, 2	Uncertainty assigned by TRC = 0.25 K; TRC
Quantity	Value	Units	Method	Reference	Comment
T_c	761. ± 1.	K	N/A	Tsonopoulos and Ambrose, 1995
T_c	761.15	K	N/A	Ambrose, 1963	Uncertainty assigned by TRC = 1.5 K; TRC
T_c	764.55	K	N/A	Glaser and Ruland, 1957	Uncertainty assigned by TRC = 2. K; TRC
Quantity	Value	Units	Method	Reference	Comment
P_c	32.9306	bar	N/A	Glaser and Ruland, 1957	Uncertainty assigned by TRC = 1.5199 bar; TRC
Quantity	Value	Units	Method	Reference	Comment
Δ_vapH°	45.31	kJ/mol	C	Glaser and Ruland, 1957	ALS
Quantity	Value	Units	Method	Reference	Comment
Δ_subH°	65.69 ± 0.84	kJ/mol	C	Sabbah, Chastel, et al., 1974	ALS
Δ_subH°	71.3 ± 2.1	kJ/mol	V	Speros and Rossini, 1960	Hfusion=2.83±0.01; ALS
Δ_subH°	71.2	kJ/mol	N/A	Speros and Rossini, 1960	DRB

Enthalpy of vaporization

Δ_vapH (kJ/mol)	Temperature (K)	Method	Reference	Comment
51.2	438.	A,GS	Stephenson and Malanowski, 1987	Based on data from 423. to 515. K. See also Camin and Rossini, 1955.; AC
48.4	465.	N/A	Wieczorek and Kobayashi, 1981	Based on data from 424. to 535. K.; AC
46.4	505.	N/A	Wieczorek and Kobayashi, 1981	Based on data from 424. to 535. K.; AC

Antoine Equation Parameters

log₁₀(P) = A − (B / (T + C))
P = vapor pressure (bar)
T = temperature (K)

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Temperature (K)	A	B	C	Reference
412.34 to 514.91	4.1934	1840.268	-74.755	Camin and Rossini, 1955

Enthalpy of sublimation

Δ_subH (kJ/mol)	Temperature (K)	Method	Reference	Comment
61.71 ± 0.84	283.	V	Karyakin, Rabinovich, et al., 1968	ALS

Enthalpy of fusion

Δ_fusH (kJ/mol)	Temperature (K)	Reference	Comment
12.13	307.7	Domalski and Hearing, 1996	AC
11.966	307.2	Huffman, Parks, et al., 1931	DH

Entropy of fusion

Δ_fusS (J/mol*K)	Temperature (K)	Reference	Comment
39.0	307.2	Huffman, Parks, et al., 1931	DH

Entropy of fusion

Δ_fusS (J/mol*K)	Temperature (K)	Reference	Comment
19.43	288.5	Domalski and Hearing, 1996	CAL
39.43	307.7	Domalski and Hearing, 1996	CAL

Enthalpy of phase transition

ΔH_trs (kJ/mol)	Temperature (K)	Initial Phase	Final Phase	Reference	Comment
5.606	288.5	crystaline, II	crystaline, I	McCullough, Finke, et al., 1957	DH
12.125	307.73	crystaline, I	liquid	McCullough, Finke, et al., 1957	DH

Entropy of phase transition

ΔS_trs (J/mol*K)	Temperature (K)	Initial Phase	Final Phase	Reference	Comment
19.43	288.5	crystaline, II	crystaline, I	McCullough, Finke, et al., 1957	DH
39.40	307.73	crystaline, I	liquid	McCullough, Finke, et al., 1957	DH

In addition to the Thermodynamics Research Center (TRC) data available from this site, much more physical and chemical property data is available from the following TRC products:

Henry's Law data

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Data compiled by: Rolf Sander

Henry's Law constant (water solution)

k_H(T) = k°_H exp(d(ln(k_H))/d(1/T) ((1/T) - 1/(298.15 K)))
k°_H = Henry's law constant for solubility in water at 298.15 K (mol/(kg*bar))
d(ln(k_H))/d(1/T) = Temperature dependence constant (K)

k°_H (mol/(kg*bar))	d(ln(k_H))/d(1/T) (K)	Method	Reference	Comment
0.0051	1200.	M	N/A
0.0050	1200.	X	N/A
2.0		Q	N/A	missing citation give several references for the Henry's law constants but don't assign them to specific species.
2.5		L	N/A

Gas Chromatography

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Henry's Law data, References, Notes

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Kovats' RI, non-polar column, isothermal

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Column type	Active phase	Temperature (C)	I	Reference	Comment
Capillary	RTX-1	120.	1259.	Arey J.S., Nelson R.K., et al., 2005	6. m/0.1 mm/0.4 μm
Capillary	Squalane	120.	1278.7	Gerasimenko and Nabivach, 1997	Column length: 50. m
Capillary	OV-1	150.	1300.	Zhang, Chen, et al., 1997	25. m/0.2 mm/0.33 μm, N2
Capillary	OV-1	150.	1300.	Zhang, Chen, et al., 1997	25. m/0.2 mm/0.33 μm, N2
Capillary	OV-1	150.	1301.	Zhang, Chen, et al., 1997	25. m/0.2 mm/0.33 μm, N2
Capillary	OV-1	160.	1307.	Zhang, Chen, et al., 1997	25. m/0.2 mm/0.33 μm, N2
Capillary	HP-1	100.	1264.	Zhang, Li, et al., 1992	N2; Column length: 25. m; Column diameter: 0.20 mm
Capillary	HP-1	100.	1264.	Zhang, Li, et al., 1992	N2; Column length: 25. m; Column diameter: 0.20 mm
Capillary	Methyl Silicone	100.	1262.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Capillary	Methyl Silicone	100.	1262.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Capillary	Methyl Silicone	100.	1262.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Capillary	Methyl Silicone	100.	1262.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Capillary	Methyl Silicone	100.	1262.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Capillary	Methyl Silicone	100.	1262.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Capillary	Methyl Silicone	100.	1262.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Capillary	Methyl Silicone	100.	1262.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Capillary	Methyl Silicone	100.	1262.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Capillary	Methyl Silicone	100.	1262.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Capillary	Methyl Silicone	100.	1263.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Capillary	Methyl Silicone	100.	1263.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Capillary	Methyl Silicone	100.	1263.	Bemgård, Blomberg, et al., 1987	Column diameter: 0.32 mm; Phase thickness: 0.25 μm
Packed	OV-1	150.	1294.	Antal, 1984	Chromosorb W HP; Column length: 2.5 m
Capillary	SE-30	100.	1265.	Bredael, 1982	Column length: 100. m; Column diameter: 0.5 mm
Capillary	SE-30	130.	1286.	Bredael, 1982	Column length: 100. m; Column diameter: 0.5 mm
Capillary	SE-30	150.	1300.	Bredael, 1982	Column length: 100. m; Column diameter: 0.5 mm
Capillary	SE-30	80.	1252.	Bredael, 1982	Column length: 100. m; Column diameter: 0.5 mm
Capillary	Squalane	86.	1265.5	Macák, Nabivach, et al., 1982	N2; Column length: 50. m; Column diameter: 0.25 mm
Capillary	Squalane	96.	1271.1	Macák, Nabivach, et al., 1982	N2; Column length: 50. m; Column diameter: 0.25 mm
Capillary	OV-101	140.	1293.9	Gerasimenko, Kirilenko, et al., 1981	N2; Column length: 50. m; Column diameter: 0.3 mm
Capillary	OV-1	130.	1287.	Engewald, Wennrich, et al., 1979	Column length: 50. m; Column diameter: 0.23 mm
Capillary	Squalane	86.	1265.5	Nabivach, Bur'yan, et al., 1978	Column length: 50. m; Column diameter: 0.25 mm
Capillary	Squalane	96.	1271.1	Nabivach, Bur'yan, et al., 1978	Column length: 50. m; Column diameter: 0.25 mm
Packed	SE-30	150.	1304.	Shlyakhov, Anvaer, et al., 1975

Kovats' RI, non-polar column, temperature ramp

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Column type	Active phase	I	Reference	Comment
Capillary	OV-101	1267.	Hayes and Pitzer, 1982	110. m/0.25 mm/0.20 μm, He, 1. K/min; T_start: 35. C; T_end: 200. C
Capillary	SE-30	1271.	Greenberg, 1981	He, 40. C @ 3. min, 3. K/min; Column length: 50. m; Column diameter: 0.5 mm; T_end: 170. C
Capillary	SE-30	1278.	Greenberg, 1981	He, 40. C @ 3. min, 3. K/min; Column length: 50. m; Column diameter: 0.5 mm; T_end: 170. C
Capillary	OV-101	1279.	Yamaguchi and Shibamoto, 1981	N2, 2. K/min; Column length: 70. m; Column diameter: 0.28 mm; T_start: 80. C; T_end: 200. C
Capillary	OV-101	1281.	Yamaguchi and Shibamoto, 1981	N2, 2. K/min; Column length: 70. m; Column diameter: 0.28 mm; T_start: 80. C; T_end: 200. C

Kovats' RI, non-polar column, custom temperature program

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Column type	Active phase	I	Reference	Comment
Capillary	Petrocol DH-100	1282.6	Haagen-Smit Laboratory, 1997	He; Column length: 100. m; Column diameter: 0.2 mm; Program: 5C(10min) => 5C/min => 50C(48min) => 1.5C/min => 195C(91min)
Capillary	DB-1	1285.	Hoekman, 1993	60. m/0.32 mm/1.0 μm, He; Program: -40 C for 12 min; -40 - 125 C at 3 deg.min; 125-185 C at 6 deg/min; 185 - 220 C at 20 deg/min; hold 220 C for 2 min

Van Den Dool and Kratz RI, non-polar column, temperature ramp

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Column type	Active phase	I	Reference	Comment
Capillary	HP-5MS	1315.3	Zeng, Zhao, et al., 2007	30. m/0.25 mm/0.25 μm, He, 4. K/min; T_start: 80. C; T_end: 300. C
Capillary	RTX-5	1312.	Ádámová, Orinák, et al., 2005	30. m/0.25 mm/0.25 μm, N2, 40. C @ 2. min, 5. K/min, 300. C @ 10. min
Capillary	PONA	1298.	Vendeuvre, Bertoncini, et al., 2005	50. m/0.2 mm/0.5 μm, 2. K/min; T_start: 50. C
Capillary	DB-5	1281.5	Song, Lai, et al., 2003	30. m/0.25 mm/0.25 μm, He, 2. K/min; T_start: 40. C; T_end: 310. C
Capillary	DB-5	1290.5	Song, Lai, et al., 2003	30. m/0.25 mm/0.25 μm, He, 4. K/min; T_start: 40. C; T_end: 310. C
Capillary	DB-5	1296.3	Song, Lai, et al., 2003	30. m/0.25 mm/0.25 μm, He, 6. K/min; T_start: 40. C; T_end: 310. C
Capillary	DB-5	1281.5	Lai and Song, 1995	30. m/0.25 mm/0.25 μm, He, 2. K/min; T_start: 40. C; T_end: 310. C
Capillary	DB-5	1290.5	Lai and Song, 1995	30. m/0.25 mm/0.25 μm, He, 4. K/min; T_start: 40. C; T_end: 310. C
Capillary	DB-5	1296.3	Lai and Song, 1995	30. m/0.25 mm/0.25 μm, He, 6. K/min; T_start: 40. C; T_end: 310. C
Capillary	DB-1	1284.	Peng, Hua, et al., 1992	30. m/0.32 mm/1.5 μm, 40. C @ 4. min, 8. K/min; T_end: 280. C
Capillary	Petrocol DH	1270.79	White, Douglas, et al., 1992	100. m/0.25 mm/0.5 μm, He, 1. K/min; T_start: 30. C; T_end: 220. C
Capillary	Petrocol DH	1271.01	White, Douglas, et al., 1992	100. m/0.25 mm/0.5 μm, He, 1. K/min; T_start: 30. C; T_end: 220. C
Capillary	Petrocol DH	1271.	White, Hackett, et al., 1992	100. m/0.25 mm/0.5 μm, He, 1. K/min; T_start: 30. C; T_end: 220. C
Capillary	DB-5	1299.	Rostad and Pereira, 1986	30. m/0.26 mm/0.25 μm, He, 50. C @ 4. min, 6. K/min, 300. C @ 20. min
Capillary	OV-101	1267.	Hayes and Pitzer, 1981	108. m/0.25 mm/0.2 μm, 1. K/min; T_start: 35. C; T_end: 200. C

Van Den Dool and Kratz RI, non-polar column, custom temperature program

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Column type	Active phase	I	Reference	Comment
Capillary	DB-5MS	1318.	Selli, Rannou, et al., 2006	30. m/0.32 mm/0.5 μm, He; Program: 50C => 5C/min => 200C => 8C/min => 260C(5min)
Capillary	HP-5	1290.6	Sandercock and du Pasquier, 2003	30. m/0.25 mm/0.25 μm, He; Program: 40C(3min) => 4C/min => 208C => 25C/min => 290C(5min)
Capillary	CP Sil 8 CB	1312.	Oruna-Concha, Bakker, et al., 2002	60. m/0.25 mm/0.25 μm, He; Program: 0C => rapidly => 40C(8min) => 4C/min => 250C(10min)
Capillary	DB-5	1314.	Havenga and Rohwer, 1999	30. m/0.25 mm/0.25 μm, He; Program: 60 0C 7 0C/min -> 130 0C 5 0C/min -> 200 0C 6 0C/min -> 260 0C 20 0C/min -> 320 0C (4 min)
Capillary	OV-101	1277.	Yasuhara, Shiraishi, et al., 1997	15. m/0.25 mm/0.25 μm, He; Program: 50C(2min) => (20C/min) => 120C => (7C/min) => 310C(10min)
Capillary	5 % Phenyl methyl siloxane	1286.	Yasuhara, Shiraishi, et al., 1997	25. m/0.31 mm/0.52 μm, He; Program: 50C(2min) => (20C/min) => 120C => (7C/min) => 310C(10min)
Capillary	Methyl Silicone	1271.	Oda, Ichikawa, et al., 1996	Program: 50C (2min) => 20C/min => 160C => 5C/min => 210C => 10C/min => 300C
Packed	SE-30	1303.	Peng, Ding, et al., 1988	Supelcoport; Chromosorb; Column length: 3.05 m; Program: 40C(5min) => 10C/min => 200C or 250C (60min)

Van Den Dool and Kratz RI, polar column, temperature ramp

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Column type	Active phase	I	Reference	Comment
Capillary	DB-Wax	1877.	Selli, Rannou, et al., 2006	30. m/0.25 mm/0.5 μm, He, 4. K/min, 260. C @ 5. min; T_start: 50. C
Capillary	Stabilwax	1856.	Cros, Lignot, et al., 2005	60. m/0.25 mm/0.25 μm, He, 40. C @ 5. min, 3. K/min, 240. C @ 10. min
Capillary	Stabilwax	1856.	Cros, Vandanjon, et al., 2003	60. m/0.25 mm/0.25 μm, He, 40. C @ 5. min, 3. K/min, 240. C @ 10. min
Capillary	Supelcowax-10	1859.	Chung, Yung, et al., 2002	60. m/0.25 mm/0.25 μm, He, 35. C @ 5. min, 2. K/min, 195. C @ 90. min
Capillary	Supelcowax-10	1859.	Chung, Yung, et al., 2001	60. m/0.25 mm/0.25 μm, He, 35. C @ 5. min, 2. K/min, 195. C @ 90. min
Capillary	DB-Wax	1877.	Le Guen, Prost, et al., 2000	60. m/0.32 mm/0.5 μm, He, 40. C @ 2. min, 4. K/min, 250. C @ 10. min
Capillary	Supelcowax-10	1860.	Chung, 1999	60. m/0.25 mm/0.25 μm, He, 35. C @ 5. min, 2. K/min, 195. C @ 90. min
Capillary	Supelcowax-10	1868.	Tanchotikul and Hsieh, 1989	60. m/0.25 mm/0.25 μm, 40. C @ 5. min, 2. K/min, 175. C @ 20. min
Capillary	Supelcowax-10	1868.	Tanchotikul and Hsieh, 1989	60. m/0.25 mm/0.25 μm, 40. C @ 5. min, 2. K/min, 175. C @ 20. min
Capillary	Supelcowax-10	1863.	Vejaphan, Hsieh, et al., 1988	60. m/0.25 mm/0.25 μm, 40. C @ 5. min, 2. K/min, 175. C @ 20. min
Capillary	Supelcowax-10	1868.	Vejaphan, Hsieh, et al., 1988	60. m/0.25 mm/0.25 μm, 40. C @ 5. min, 2. K/min, 175. C @ 20. min

Normal alkane RI, non-polar column, isothermal

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Column type	Active phase	Temperature (C)	I	Reference	Comment
Capillary	OV-101	120.	1304.	Nabivach and Gerasimenko, 1996
Capillary	Polidimethyl siloxane	130.	1286.	Nabivach and Gerasimenko, 1996
Capillary	Polidimethyl siloxane	130.	1287.	Nabivach and Gerasimenko, 1996
Capillary	Polidimethyl siloxane	130.	1291.	Nabivach and Gerasimenko, 1996
Capillary	Squalane	120.	1276.	Nabivach and Gerasimenko, 1996
Capillary	Squalane	120.	1279.	Nabivach and Gerasimenko, 1996
Capillary	Squalane	120.	1280.	Nabivach and Gerasimenko, 1996
Capillary	Squalane	130.	1280.	Papazova and Pankova, 1975	N2; Column length: 100. m; Column diameter: 0.25 mm
Packed	Polydimethyl siloxane	147.	1296.	Ferrand, 1962

Normal alkane RI, non-polar column, temperature ramp

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Column type	Active phase	I	Reference	Comment
Capillary	Polydimethyl siloxane: CP-Sil 5 CB	1292.	Bramston-Cook, 2013	60. m/0.25 mm/1.0 μm, Helium, 45. C @ 1.45 min, 3.6 K/min, 210. C @ 2.72 min
Capillary	HP-5 MS	1286.	Kotowska, Zalikowski, et al., 2012	30. m/0.25 mm/0.25 μm, Helium, 35. C @ 5. min, 3. K/min, 300. C @ 15. min
Capillary	Petrocol DH	1273.	Supelco, 2012	100. m/0.25 mm/0.50 μm, Helium, 20. C @ 15. min, 15. K/min, 220. C @ 30. min
Capillary	VF-5 MS	1299.	Leffingwell and Alford, 2011	60. m/0.32 mm/0.25 μm, Helium, 2. K/min, 260. C @ 28. min; T_start: 30. C
Capillary	VF-5 MS	1299.	Leffingwell and Alford, 2011	60. m/0.32 mm/0.25 μm, Helium, 2. K/min, 260. C @ 28. min; T_start: 30. C
Capillary	HP-5 MS	1300.	Lazarevic, Radulovic, et al., 2010	30. m/0.25 mm/0.25 μm, Helium, 5. K/min; T_start: 70. C; T_end: 290. C
Capillary	HP-5 MS	1299.	Radulovic, Blagojevic, et al., 2010	30. m/0.25 mm/0.25 μm, Helium, 5. K/min, 290. C @ 10. min; T_start: 70. C
Capillary	HP-5	1300.	Radulovic, Dordevic, et al., 2010	30. m/0.25 mm/0.25 μm, Hydrogen, 5. K/min; T_start: 70. C; T_end: 290. C
Capillary	HP-5 MS	1301.	Radulovic, Dordevic, et al., 2010, 2	30. m/0.25 mm/0.25 μm, Helium, 5. K/min, 290. C @ 10. min; T_start: 70. C
Capillary	ZB-5	1306.	Harrison and Priest, 2009	30. m/0.25 mm/0.25 μm, Helium, 40. C @ 1. min, 6. K/min, 280. C @ 9. min
Capillary	HP-5	1294.8	Leffingwell and Alford, 2005	60. m/0.32 mm/0.25 μm, He, 30. C @ 2. min, 2. K/min, 260. C @ 28. min
Capillary	HP-5	1270.	N/A	30. m/0.32 mm/0.25 μm, Helium, 40. C @ 2. min, 5. K/min, 250. C @ 5. min
Capillary	BP-1	1310.	Health Safety Executive, 2000	50. m/0.22 mm/0.75 μm, He, 5. K/min; T_start: 50. C; T_end: 200. C
Capillary	OV-1	1269.	Orav, Kailas, et al., 1999	2. K/min; T_start: 50. C; T_end: 160. C
Capillary	Ultra-1	1278.	Elizalde-González, Hutfliess, et al., 1996	50. m/0.2 mm/0.33 μm, H2, 3. K/min, 300. C @ 35. min; T_start: 60. C
Capillary	DB-1	1273.	Ciccioli, Cecinato, et al., 1992	60. m/0.32 mm/1.2 μm, He, 30. C @ 10. min, 3. K/min; T_end: 240. C
Capillary	Ultra-1	1263.	Okumura, 1991	25. m/0.32 mm/0.25 μm, He, 3. K/min; T_start: 80. C; T_end: 260. C
Capillary	SE-30	1264.	Ibrahim and Suffet, 1988	N2, 50. C @ 8. min, 5. K/min, 275. C @ 10. min; Column length: 60. m; Column diameter: 0.32 mm
Capillary	DB-1	1267.	Habu, Flath, et al., 1985	3. K/min; Column length: 50. m; Column diameter: 0.32 mm; T_start: 0. C; T_end: 250. C
Capillary	DB-1	1264.	Habu, Flath, et al., 1985	3. K/min; Column length: 50. m; Column diameter: 0.32 mm; T_start: 50. C; T_end: 250. C
Capillary	DB-1	1267.	Flath, Mon, et al., 1983	50. C @ 0.1 min, 4. K/min, 250. C @ 5. min; Column length: 60. m; Column diameter: 0.32 mm
Capillary	SE-30	1288.	Heydanek and McGorrin, 1981	40. C @ 3. min, 3. K/min; Column length: 50. m; Column diameter: 0.5 mm; T_end: 170. C
Capillary	SE-30	1274.	Heydanek and McGorrin, 1981, 2	He, 40. C @ 3. min, 3. K/min; Column length: 50. m; Column diameter: 0.5 mm; T_end: 170. C

Normal alkane RI, non-polar column, custom temperature program

View large format table.

Column type	Active phase	I	Reference	Comment
Capillary	HP-5 MS	1291.	Kotowska, Zalikowski, et al., 2012	30. m/0.25 mm/0.25 μm, Helium; Program: not specified
Capillary	SLB-5 MS	1307.	Mondello, 2012	30. m/0.25 mm/0.25 μm, Helium; Program: not specified
Capillary	SLB-5 MS	1308.	Mondello, 2012	30. m/0.25 mm/0.25 μm, Helium; Program: not specified
Capillary	Polydimethyl siloxane with 5 % Ph groups	1315.	Robinson, Adams, et al., 2012	Program: not specified
Capillary	HP-5	1310.	Zhao, Li, et al., 2008	30. m/0.25 mm/0.25 μm; Program: 40 0C (2 min) 5 0C/min -> 80 0C 7 oC/min -> 160 0C 9 0C/min -> 200 0C 20 0C/min -> 280 0C (10 min)
Capillary	RTX-5	1312.	Ádámová, Orinák, et al., 2005	30. m/0.25 mm/0.25 μm, N2; Program: not specified
Capillary	HP-5MS	1289.	Vichi, Pizzale, et al., 2005	30. m/0.25 mm/0.25 μm; Program: 40C(3min) => 4C/min => 75C => 8C/min => 250C
Capillary	Methyl Silicone	1277.	Oda, Yasuhara, et al., 1998	25. m/0.25 mm/0.25 μm, He; Program: 50 0C (2 min) 20 0C/min -> 160 0C 5 0C/min -> 210 0C 10 0C/min -> 300 0C
Capillary	DB-1	1303.	Peng, 1996	30. m/0.53 mm/1.5 μm; Program: 40 0C (4 min) 8 0C/min -> 200 0C (1 min) 5 0C/min -> 280 0C (20 min)
Capillary	RSL-150	1276.	Buchbauer, Nikiforov, et al., 1994	60. m/0.32 mm/0.25 μm, He; Program: 30c (1.5min) => 20C/min => 55C => 6C/min => 200C(10min)
Capillary	DB-1	1266.	Ciccioli, Cecinato, et al., 1994	60. m/0.32 mm/0.25 μm; Program: not specified
Capillary	OV-1	1286.8	Dimov, Osman, et al., 1994	Program: not specified
Capillary	OV-101	1263.	Matisová, Juranyiová, et al., 1991	52. m/0.25 mm/0.38 μm, H2; Program: 70 - 160 C at 1.5 deg/min; 160 - 280 C at 15 deg/min 15 min at 280 C
Capillary	Polydimethyl siloxane, unknown content of Ph-groups	1298.	Geldon, 1989	Program: not specified
Capillary	Polydimethyl siloxane, unknown content of Ph-groups	1299.	Geldon, 1989	Program: not specified
Capillary	SE-30	1271.	Ibrahim and Suffet, 1988	N2; Column length: 60. m; Column diameter: 0.32 mm; Program: 50C(8min) => 3C/min => 150C => 35C/min => 275C (10min)
Capillary	DB-1	1257.	Takeoka, Flath, et al., 1988	30. m/0.25 mm/0.25 μm, H2; Program: 30C (2min) => 2C/min => 150C => 4C/min => 250C
Capillary	DB-1	1268.	Takeoka, Flath, et al., 1988	30. m/0.25 mm/0.25 μm, H2; Program: 30C (2min) => 2C/min => 150C => 4C/min => 250C
Capillary	OV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.	1273.	Waggott and Davies, 1984	Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
Capillary	OV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.	1283.	Waggott and Davies, 1984	Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
Capillary	OV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.	1287.	Waggott and Davies, 1984	Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
Capillary	OV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.	1313.	Waggott and Davies, 1984	Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
Other	Methyl Silicone	1313.	Ardrey and Moffat, 1981	Program: not specified

Normal alkane RI, polar column, temperature ramp

View large format table.

Column type	Active phase	I	Reference	Comment
Capillary	HP-Innowax	1872.	Soria, Sanz, et al., 2008	50. m/0.20 mm/0.20 μm, Helium, 45. C @ 2. min, 4. K/min, 190. C @ 50. min
Capillary	Stabilwax	1856.	Cros, Vandanjon, et al., 2007	60. m/0.25 mm/0.25 μm, Helium, 40. C @ 5. min, 3. K/min, 240. C @ 10. min
Capillary	ZB-Wax	1809.	N/A	30. m/0.32 mm/0.25 μm, Helium, 40. C @ 2. min, 5. K/min, 250. C @ 5. min
Capillary	Stabilwax	1856.	Cros, Vandanjon, et al., 2003, 2	60. m/0.25 mm/0.25 μm, Helium, 40. C @ 5. min, 3. K/min, 240. C @ 10. min

Normal alkane RI, polar column, custom temperature program

View large format table.

Column type	Active phase	I	Reference	Comment
Capillary	Supelcowax-10	1845.	Vichi, Pizzale, et al., 2005	30. m/0.25 mm/0.25 μm; Program: 40C(3min) => 4C/min => 75C => 8C/min => 250C
Capillary	DB-Wax	1852.	Peng, 1996	30. m/0.53 mm/1.0 μm; Program: 40 0C (4 min) 4 0C/min -> 200 0C (20 min)
Capillary	DB-Wax	1852.	Peng, Yang, et al., 1991	Program: not specified

Lee's RI, non-polar column, temperature ramp

View large format table.

Column type	Active phase	I	Reference	Comment
Capillary	DB-5MS	221.10	Sun, Zhou, et al., 2008	30. m/0.25 mm/0.25 μm, 50. C @ 2. min, 6. K/min, 300. C @ 16. min
Capillary	HP-5	221.5	Wang, Hou, et al., 2007	30. m/0.30 mm/0.25 μm, Helium, 50. C @ 5. min, 5. K/min, 200. C @ 15. min
Capillary	HP-5	224.9	Shao, Wang, et al., 2006	30. m/0.3 mm/0.25 μm, He, 50. C @ 5. min, 5. K/min, 200. C @ 15. min
Capillary	5 % Phenyl methyl siloxane	218.14	Skrbic and Onjia, 2006	2. K/min; T_start: 50. C; T_end: 250. C
Capillary	5 % Phenyl methyl siloxane	220.10	Skrbic and Onjia, 2006	80. C @ 2. min, 8. K/min, 300. C @ 10. min
Capillary	HP-5	220.22	Marynowski, Pieta, et al., 2004	60. m/0.25 mm/0.25 μm, He, 3. K/min; T_start: 35. C; T_end: 300. C
Capillary	HP-5	220.22	Marynowski, Pieta, et al., 2004	60. m/0.25 mm/0.25 μm, He, 3. K/min; T_start: 35. C; T_end: 300. C
Capillary	DB-5MS	221.51	Chen, Keeran, et al., 2002	30. m/0.25 mm/0.5 μm, 40. C @ 1. min, 10. K/min; T_end: 310. C
Capillary	DB-5MS	220.98	Chen, Keeran, et al., 2002	30. m/0.25 mm/0.5 μm, 40. C @ 1. min, 4. K/min; T_end: 310. C
Capillary	PTE-5	220.93	Wang, Jia, et al., 2000	30. m/0.25 mm/0.25 μm, 60. C @ 1.5 min, 8. K/min, 300. C @ 12.5 min
Capillary	HP-5	220.73	Piao, Chu, et al., 1999	30. m/0.25 mm/0.25 μm, 50. C @ 2. min, 4. K/min, 280. C @ 20. min
Capillary	HP-5	220.89	Piao, Chu, et al., 1999	30. m/0.25 mm/0.25 μm, 50. C @ 2. min, 4. K/min, 280. C @ 20. min
Capillary	SE-52	220.11	Wang, Peng, et al., 1997	4. K/min; Column length: 30. m; Column diameter: 0.30 mm; T_start: 40. C; T_end: 250. C
Capillary	SE-54	219.13	Chen, 1996	4. K/min; Column length: 30. m; Column diameter: 0.25 mm; T_start: 50. C; T_end: 300. C
Capillary	DB-5	220.93	Williams and Horne, 1995	He, 60. C @ 2. min, 5. K/min; Column length: 25. m; Column diameter: 0.3 mm; T_end: 270. C
Capillary	DB-5	221.27	Wang, Fingas, et al., 1994	30. m/0.32 mm/0.25 μm, He, 50. C @ 2. min, 6. K/min; T_end: 300. C
Capillary	DB-5	221.1	Donnelly, Abdel-Hamid, et al., 1993	30. m/0.32 mm/0.25 μm, He, 40. C @ 3. min, 8. K/min, 285. C @ 29.5 min
Capillary	CP Sil 8 CB	220.5	Bundt, Herbel, et al., 1991	50. m/0.25 mm/0.25 μm, He, 4. K/min; T_start: 80. C; T_end: 300. C
Capillary	SE-54	220.53	Guillén, Blanco, et al., 1989	20. m/0.22 mm/0.20 μm, He, 4. K/min; T_start: 50. C; T_end: 300. C
Capillary	DB-5	217.33	Sye, Lin, et al., 1988	30. m/0.32 mm/0.25 μm, 80. C @ 1. min, 3. K/min; T_end: 290. C
Capillary	DB-5	220.47	Wise, Benner, et al., 1988	30. m/0.25 mm/0.25 μm, 40. C @ 2. min, 4. K/min, 280. C @ 5. min
Capillary	DB-5	221.57	Rostad and Pereira, 1986	30. m/0.26 mm/0.25 μm, He, 50. C @ 4. min, 6. K/min, 300. C @ 20. min
Capillary	DB-5	217.00	Tong, Centen, et al., 1985	He, 4. K/min; Column length: 30. m; Column diameter: 0.25 mm; T_start: 90. C; T_end: 325. C
Capillary	DB-5	216.185	Tong, Shore, et al., 1984	He, 80. C @ 1. min, 3. K/min, 300. C @ 10. min; Column length: 30. m; Column diameter: 0.32 mm
Capillary	DB-5	216.6	Viau, Studak, et al., 1984	Helium, 4. K/min; Column length: 30. m; Column diameter: 0.32 mm; T_start: 90. C; T_end: 250. C
Capillary	SE-52	220.22	Vassilaros, Kong, et al., 1982	20. m/0.30 mm/0.25 μm, H2, 40. C @ 2. min, 4. K/min; T_end: 265. C
Capillary	SE-52	218.14	Lee, Vassilaros, et al., 1979	12. m/0.3 mm/0.34 μm, He, 2. K/min; T_start: 50. C; T_end: 250. C

Lee's RI, non-polar column, custom temperature program

View large format table.

Column type	Active phase	I	Reference	Comment
Capillary	DB-5	221.5	Fuentes, Font, et al., 2007	Column length: 60. m; Program: not specified
Capillary	HP-5MS	221.1	Wang, Li, et al., 2007	30. m/0.25 mm/0.25 μm, He; Program: 60C(2min) => 6C/min => 258C => 2C/min => 300C(4min)
Capillary	HP-5MS	220.47	Wang, Li, et al., 2007, 2	30. m/0.25 mm/0.25 μm, He; Program: not specified
Capillary	HP-5MS	221.10	Wang, Li, et al., 2007, 2	30. m/0.25 mm/0.25 μm, He; Program: not specified
Capillary	DB-5MS	221.2	Aracil, Font, et al., 2005	Column length: 60. m; Column diameter: 0.25 mm; Program: not specified
Capillary	HP-5MS	217.29	Cheng, Liu, et al., 2005	30. m/0.30 mm/0.25 μm, He; Program: 50 0C (2 min) 8 0C/min -> 120 0C (3 min) 10 0C/min -> 230 0C
Capillary	LM-5	219.86	Ré-Poppi and Santiago-Silva, 2005	30. m/0.25 mm/0.25 μm, He; Program: 60C(2min) => 15C/min => 180C => 5C/min => 280C (10min)
Capillary	Ultra-1	218.1	Sremac, Skrbic, et al., 2005	50. m/0.32 mm/0.50 μm, Nitrogen; Program: 40-100 0C 3-15 0C/min -> 290 0C
Capillary	Ultra-1	220.1	Sremac, Skrbic, et al., 2005	50. m/0.32 mm/0.50 μm, Nitrogen; Program: 40-100 0C 3-15 0C/min -> 290 0C
Capillary	DB-5	220.1	Lundstedt, Haglund, et al., 2003	30. m/0.25 mm/0.25 μm; Program: not specified
Capillary	HP-5	221.22	Sandercock and du Pasquier, 2003	30. m/0.25 mm/0.25 μm, He; Program: 40C(3min) => 4C/min => 208C => 25C/min => 290C(5min)
Capillary	LM-5	216.32	Ré-Poppi and Santiago-Silva, 2002	30. m/0.25 mm/0.25 μm, He; Program: 60C(2min) => 15C/min => 180C => 5C/min => 280C(5min)
Capillary	SE-52	218.74	Wang, Peng, et al., 1997	Column length: 30. m; Column diameter: 0.30 mm; Program: not specified
Capillary	SE-54	218.14	Chen, 1996	Column length: 30. m; Column diameter: 0.25 mm; Program: not specified
Capillary	SE-54	220.06	Guillen, Iglesias, et al., 1992	Program: not specified
Capillary	DB-5	220.4	Paschke, Herbel, et al., 1992	30. m/0.25 mm/0.25 μm, He; Program: 60 0C (3 min) 10 0C/min -> 100 0C (3 min) 5 0C/min -> 300 0C
Capillary	CP Sil 8 CB	220.2	Bundt, Herbel, et al., 1991	50. m/0.25 mm/0.25 μm, He; Program: not specified
Capillary	CP Sil 8 CB	220.5	Bundt, Herbel, et al., 1991	50. m/0.25 mm/0.25 μm, He; Program: not specified
Capillary	DB-5	218.14	Naikwadi, Charbonneau, et al., 1987	Column length: 30. m; Column diameter: 0.32 mm; Program: not specified
Capillary	DB-5	218.21	Naikwadi, Charbonneau, et al., 1987	Column length: 30. m; Column diameter: 0.32 mm; Program: not specified
Capillary	DB-5	218.14	Tong, Centen, et al., 1985	He; Column length: 30. m; Column diameter: 0.25 mm; Program: not specified

References

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Henry's Law data, Gas Chromatography, Notes

Speros and Rossini, 1960
Speros, D.M.; Rossini, F.D., Heats of combustion and formation of naphthalene, the two methylnaphthalenes, cis and trans decahydronaphthalene and related compounds, J. Phys. Chem., 1960, 64, 1723-1727. [all data]

Richardson and Parks, 1939
Richardson, J.W.; Parks, G.S., Thermal data on organic compounds. XIX. Modern combustion data for some non-volatile compounds containing carbon, hydrogen and oxygen, J. Am. Chem. Soc., 1939, 61, 3543-3546. [all data]

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McCullough, J.P.; Finke, H.L.; Messerly, J.F.; Kincheloe, T.C.; Waddington, G., The low temperature thermodynamic properties of naphthalene, 1-methylnaphthalene, 2-methylnaphthalene, 1,2,3,4-tetrahydronaphthalene, trans-decahydronaphthalene and cis-decahydronaphthalene, J. Phys. Chem., 1957, 61, 1105-1116. [all data]

Huffman, Parks, et al., 1931
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McCullough, J.P.; Finke, H.L.; Messerly, J.F.; Todd, S.S.; Kincheloe, T.C.; Waddington, G., The Low-Temperature Thermodynamic Properties of Naphthalene, 1-Methylnaphthalene, 2-Methylnaphthalene, 1,2,3,4-tetrahydro- naphthalene, trans-decahydronaphthalene and cis-Decahydronaphthalene, J. Phys. Chem., 1957, 61, 1105. [all data]

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Huffman, H.M.; Parks, G.S.; Barmore, M., Thermal Data on Organic Compounds X. Further Studies on the Heat Capacities, Entropies, and Free Energies of Hydrocarbons, J. Am. Chem. Soc., 1931, 53, 3876-88. [all data]

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Karyakin, N.V.; Rabinovich, I.B.; Pakhomov, L.G., Heats of sublimation of naphthalene and its monosubstituted β-derivatives, Russ. J. Phys. Chem. (Engl. Transl.), 1968, 42, 954. [all data]

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Bemgård, A.; Blomberg, L.; Lymann, M.; Claude, S.; Tabacchi, R., Siloxane/silarylene copolymers as stationary phases for capillary gas chromatography. Part I: Evaluation of silanol terminated dimethyl substituted polymers, J. Hi. Res. Chromatogr. Chromatogr. Comm., 1987, 10, 5, 302-318, https://doi.org/10.1002/jhrc.1240100516 . [all data]

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Bredael, P., Retention indices of hydrocarbons on SE-30, J. Hi. Res. Chromatogr. Chromatogr. Comm., 1982, 5, 6, 325-328, https://doi.org/10.1002/jhrc.1240050610 . [all data]

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Macák, J.; Nabivach, V.; Buryan, P.; Sindler, S., Dependence of retention indices of alkylbenzenes on their molecular structure, J. Chromatogr., 1982, 234, 2, 285-302, https://doi.org/10.1016/S0021-9673(00)81867-1 . [all data]

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Notes

Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Phase change data, Henry's Law data, Gas Chromatography, References

Symbols used in this document:

C_p,gas	Constant pressure heat capacity of gas
C_p,liquid	Constant pressure heat capacity of liquid
P_c	Critical pressure
S°_liquid	Entropy of liquid at standard conditions
T_boil	Boiling point
T_c	Critical temperature
T_fus	Fusion (melting) point
T_triple	Triple point temperature
d(ln(k_H))/d(1/T)	Temperature dependence parameter for Henry's Law constant
k°_H	Henry's Law constant at 298.15K
ΔH_trs	Enthalpy of phase transition
ΔS_trs	Entropy of phase transition
Δ_cH°_solid	Enthalpy of combustion of solid at standard conditions
Δ_fH°_gas	Enthalpy of formation of gas at standard conditions
Δ_fH°_solid	Enthalpy of formation of solid at standard conditions
Δ_fusH	Enthalpy of fusion
Δ_fusS	Entropy of fusion
Δ_subH	Enthalpy of sublimation
Δ_subH°	Enthalpy of sublimation at standard conditions
Δ_vapH	Enthalpy of vaporization
Δ_vapH°	Enthalpy of vaporization at standard conditions

Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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