Acenaphthene
- Formula: C12H10
- Molecular weight: 154.2078
- IUPAC Standard InChIKey: CWRYPZZKDGJXCA-UHFFFAOYSA-N
- CAS Registry Number: 83-32-9
- 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. - Isotopologues:
- Other names: Acenaphthylene, 1,2-dihydro-; Peri-Ethylenenaphthalene; Naphthyleneethylene; 1,2-Dihydroacenaphthylene; 1,8-Ethylenenaphthalene; Acenaphtene
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Condensed phase thermochemistry data
Go To: Top, Phase change data, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled as indicated in comments:
DRB - Donald R. Burgess, Jr.
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°solid | 72. ± 3.1 | kJ/mol | Review | Roux, Temprado, et al., 2008 | There are sufficient literature values to make a qualified recommendation where the suggested value is in good agreement with values predicted using thermochemical cycles or from reliable estimates. In general, the evaluated uncertainty limits are on the order of (2 to 4) kJ/mol.; DRB |
ΔfH°solid | 70. ± 3. | kJ/mol | Ccb | Boyd, Christensen, et al., 1965 | ALS |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°solid | -6222. ± 3. | kJ/mol | Ccb | Boyd, Christensen, et al., 1965 | Corresponding ΔfHºsolid = 70.3 kJ/mol (simple calculation by NIST; no Washburn corrections); ALS |
Quantity | Value | Units | Method | Reference | Comment |
S°solid,1 bar | 188.87 | J/mol*K | N/A | Finke, Messerly, et al., 1977 | DH |
Constant pressure heat capacity of solid
Cp,solid (J/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
190.37 | 298.15 | Finke, Messerly, et al., 1977 | T = 10 to 440 K.; DH |
185.8 | 298. | Sadowska, Stepniewska, et al., 1969 | T = 20 to 93°C, equation only; liquid, 93 to 200°C, equation only.; DH |
210.5 | 298.1 | Eibert, 1944 | T = 25 to 200°C, equations only in t°C. Cp(c) = 0.2756 + 0.001854t cal/g*K (25 to 60°C); Cp(liq) = 0.409 + 0.000598t cal/g*K (95 to 200°C).; DH |
Phase change data
Go To: Top, Condensed phase thermochemistry data, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled as indicated in comments:
BS - Robert L. Brown and Stephen E. Stein
TRC - Thermodynamics Research Center, NIST Boulder Laboratories, Chris Muzny director
AC - William E. Acree, Jr., James S. Chickos
DRB - Donald R. Burgess, Jr.
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
DH - Eugene S. Domalski and Elizabeth D. Hearing
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 552.2 | K | N/A | Weast and Grasselli, 1989 | BS |
Tboil | 552. | K | N/A | Buckingham and Donaghy, 1982 | BS |
Tboil | 502.65 | K | N/A | Perkin, 1896 | Uncertainty assigned by TRC = 1. K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
Tfus | 367. ± 4. | K | AVG | N/A | Average of 13 values; Individual data points |
Quantity | Value | Units | Method | Reference | Comment |
Ttriple | 366.56 | K | N/A | Finke, Messerly, et al., 1977, 2 | Uncertainty assigned by TRC = 0.02 K; TRC |
Ttriple | 366.55 | K | N/A | Osborn and Douslin, 1975 | Uncertainty assigned by TRC = 0.02 K; TRC |
Quantity | Value | Units | Method | Reference | Comment |
ΔvapH° | 68.0 | kJ/mol | CGC | Zhao, Unhannanant, et al., 2008 | AC |
ΔvapH° | 70.5 ± 1.1 | kJ/mol | GC | Haftka, Parsons, et al., 2006 | Based on data from 363. to 423. K.; AC |
ΔvapH° | 66.2 | kJ/mol | CGC | Chickos, Hesse, et al., 1998 | AC |
ΔvapH° | 66.2 | kJ/mol | N/A | Ruuzicka, Mokbel, et al., 1998 | See also Hanshaw, Nutt, et al., 2008.; AC |
ΔvapH° | 66.5 ± 1.3 | kJ/mol | N/A | Mokbel, Guetachew, et al., 1995 | See also Hanshaw, Nutt, et al., 2008.; AC |
Quantity | Value | Units | Method | Reference | Comment |
ΔsubH° | 84.8 ± 0.4 | kJ/mol | Review | Roux, Temprado, et al., 2008 | There are sufficient high-quality literature values to make a good evaluation with a high degree of confidence. In general, the evaluated uncertainty limits are on the order of (0.5 to 2.5) kJ/mol.; DRB |
ΔsubH° | 84.6 | kJ/mol | CGC-DSC | Chickos, Hesse, et al., 1998 | AC |
ΔsubH° | 83.4 ± 1.0 | kJ/mol | N/A | Osborn and Douslin, 1975, 2 | See also Finke, Messerly, et al., 1977.; AC |
ΔsubH° | 86. ± 1. | kJ/mol | V | Boyd, Christensen, et al., 1965 | ALS |
ΔsubH° | 86.0 | kJ/mol | N/A | Boyd, Christensen, et al., 1965 | DRB |
Enthalpy of vaporization
ΔvapH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
63.9 | 398. | GC | Lei, Chankalal, et al., 2002 | Based on data from 323. to 473. K.; AC |
61.1 | 366. | N/A | Ruuzicka, Mokbel, et al., 1998 | See also Hanshaw, Nutt, et al., 2008.; AC |
60.6 | 378. | N/A | Mokbel, Guetachew, et al., 1995 | See also Hanshaw, Nutt, et al., 2008.; AC |
54. | 403. | A | Stephenson and Malanowski, 1987 | Based on data from 368. to 552. K.; AC |
60.3 | 383. | A | Stephenson and Malanowski, 1987 | Based on data from 368. to 413. K. See also Osborn and Douslin, 1975, 2 and Boublik, Fried, et al., 1984.; AC |
61.3 | 395. | I | Cramer, 1943 | AC |
54.3 | 466. | I | Mortimer and Murphy, 1923 | Based on data from 413. to 561. K.; AC |
55.4 | 435. | N/A | Mortimer and Murphy, 1923 | Based on data from 420. to 561. K. See also Boublik, Fried, et al., 1984.; AC |
Antoine Equation Parameters
log10(P) = A − (B / (T + C))
P = vapor pressure (bar)
T = temperature (K)
View plot Requires a JavaScript / HTML 5 canvas capable browser.
Temperature (K) | A | B | C | Reference | Comment |
---|---|---|---|---|---|
368. to 413. | 4.32236 | 2062.099 | -73.146 | Osborn and Douslin, 1975, 2 | Coefficents calculated by NIST from author's data. |
420.4 to 560.9 | 4.93117 | 2611.29 | -20.227 | Mortimer and Murphy, 1923 | Coefficents calculated by NIST from author's data. |
Enthalpy of sublimation
ΔsubH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
83.2 | 383. | GS | Nass, Lenoir, et al., 1995 | Based on data from 313. to 453. K.; AC |
77.0 | 318. | GS | SATO, INOMATA, et al., 1986 | Based on data from 293. to 342. K.; AC |
86.8 ± 0.9 | 303. | GS | Sonnefeld, Zoller, et al., 1983 | Based on data from 283. to 323. K.; AC |
82.4 | 366. | B | Osborn and Douslin, 1975, 2 | AC |
84.7 ± 2.7 | 283. | V | Radchenko and Kitaigorodskii, 1974 | ALS |
86.2 ± 0.8 | 290. to 340. | ME | Boyd, Christensen, et al., 1965 | See also Cox and Pilcher, 1970.; AC |
82.13 ± 0.42 | 368. | V | Aihara, 1959 | crystal phase; ALS |
82.1 ± 0.4 | 300. | V | Aihara, 1959, 2 | Based on data from 291. to 310. K. See also Stephenson and Malanowski, 1987.; AC |
81.6 | 258. to 308. | N/A | Hoyer and Peperle, 1958 | AC |
Enthalpy of fusion
ΔfusH (kJ/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
21.4622 | 366.56 | N/A | Finke, Messerly, et al., 1977 | DH |
21.0 | 367. | DSC | Sharma, Gupta, et al., 2008 | AC |
21.46 | 366.6 | N/A | Domalski and Hearing, 1996 | AC |
20.233 | 366.4 | N/A | Sadowska, Stepniewska, et al., 1969 | DH |
25.100 | 367.8 | N/A | Eibert, 1944 | DH |
Entropy of fusion
ΔfusS (J/mol*K) | Temperature (K) | Reference | Comment |
---|---|---|---|
58.55 | 366.56 | Finke, Messerly, et al., 1977 | DH |
55.22 | 366.4 | Sadowska, Stepniewska, et al., 1969 | DH |
68.2 | 367.8 | Eibert, 1944 | DH |
References
Go To: Top, Condensed phase thermochemistry data, Phase change data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Roux, Temprado, et al., 2008
Roux, M.V.; Temprado, M.; Chickos, J.S.; Nagano, Y.,
Critically Evaluated Thermochemical Properties of Polycyclic Aromatic Hydrocarbons,
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Boyd, Christensen, et al., 1965
Boyd, R.H.; Christensen, R.L.; Pua, R.,
The heats of combustion of acenaphthene, acenaphthylene, and fluoranthene. Strain and delocalization in bridged naphthalenes,
J. Am. Chem. Soc., 1965, 87, 3554-3559. [all data]
Finke, Messerly, et al., 1977
Finke, H.L.; Messerly, J.F.; Lee, S.H.; Osborn, A.G.; Douslin, D.R.,
Comprehensive thermodynamic studies of seven aromatic hydrocarbons,
J. Chem. Thermodyn., 1977, 9, 937-956. [all data]
Sadowska, Stepniewska, et al., 1969
Sadowska, K.W.; Stepniewska, G.B.; Recko, W.M.,
Specific heat and enthalpy of fusion of acenaphthene and acenaphthylene,
Przem. Chem., 1969, 48, 282-285. [all data]
Eibert, 1944
Eibert, J.,
Thesis Washington University (St. Louis), 1944. [all data]
Weast and Grasselli, 1989
CRC Handbook of Data on Organic Compounds, 2nd Editon, Weast,R.C and Grasselli, J.G., ed(s)., CRC Press, Inc., Boca Raton, FL, 1989, 1. [all data]
Buckingham and Donaghy, 1982
Buckingham, J.; Donaghy, S.M.,
Dictionary of Organic Compounds: Fifth Edition, Chapman and Hall, New York, 1982, 1. [all data]
Perkin, 1896
Perkin, W.H.,
LXIX. On Magnetic Rotatory Power, especially of Aromatic Compounds,
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Finke, Messerly, et al., 1977, 2
Finke, H.L.; Messerly, J.F.; Lee, S.H.; Osborn, A.G.; Douslin, D.R.,
Comprehensive thermodynamic studies of seven aromatic hydrocarbons,
J. Chem. Thermodyn., 1977, 9, 937. [all data]
Osborn and Douslin, 1975
Osborn, A.G.; Douslin, D.R.,
Vapor Pressure and Derived Enthalpies of Vaporization for Some Condensed Ring Hydrocarbons,
J. Chem. Eng. Data, 1975, 20, 229-31. [all data]
Zhao, Unhannanant, et al., 2008
Zhao, Hui; Unhannanant, Patamaporn; Hanshaw, William; Chickos, James S.,
Enthalpies of Vaporization and Vapor Pressures of Some Deuterated Hydrocarbons. Liquid-Vapor Pressure Isotope Effects,
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Haftka, Parsons, et al., 2006
Haftka, Joris J.H.; Parsons, John R.; Govers, Harrie A.J.,
Supercooled liquid vapour pressures and related thermodynamic properties of polycyclic aromatic hydrocarbons determined by gas chromatography,
Journal of Chromatography A, 2006, 1135, 1, 91-100, https://doi.org/10.1016/j.chroma.2006.09.050
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Chickos, Hesse, et al., 1998
Chickos, James; Hesse, Donald; Hosseini, Sarah; Nichols, Gary; Webb, Paul,
Sublimation enthalpies at 298.15K using correlation gas chromatography and differential scanning calorimetry measurements,
Thermochimica Acta, 1998, 313, 2, 101-110, https://doi.org/10.1016/S0040-6031(97)00432-2
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Ruuzicka, Mokbel, et al., 1998
Ruuzicka, Kvetoslav; Mokbel, Ilham; Majer, Vladimir; Ruuzicka, Vlastimil; Jose, Jacques; Zábranský, Milan,
Description of vapour--liquid and vapour--solid equilibria for a group of polycondensed compounds of petroleum interest,
Fluid Phase Equilibria, 1998, 148, 1-2, 107-137, https://doi.org/10.1016/S0378-3812(98)00200-3
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Hanshaw, Nutt, et al., 2008
Hanshaw, William; Nutt, Marjorie; Chickos, James S.,
Hypothetical Thermodynamic Properties. Subcooled Vaporization Enthalpies and Vapor Pressures of Polyaromatic Hydrocarbons,
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Mokbel, Guetachew, et al., 1995
Mokbel, I.; Guetachew, T.; Jose, J.,
Vapor pressures and sublimation pressures of 14 polycyclic aromatic hydrocarbons (C11 - C18) at pressures in the range from 0.5 Pa to 30 kPa,
ELDATA: Int. Electron. J. Phys. Chem. Data, 1995, 1, 2, 167. [all data]
Osborn and Douslin, 1975, 2
Osborn, Ann G.; Douslin, Donald R.,
Vapor pressures and derived enthalpies of vaporization for some condensed-ring hydrocarbons,
J. Chem. Eng. Data, 1975, 20, 3, 229-231, https://doi.org/10.1021/je60066a022
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Lei, Chankalal, et al., 2002
Lei, Ying Duan; Chankalal, Raymond; Chan, Anita; Wania, Frank,
Supercooled Liquid Vapor Pressures of the Polycyclic Aromatic Hydrocarbons,
J. Chem. Eng. Data, 2002, 47, 4, 801-806, https://doi.org/10.1021/je0155148
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Stephenson and Malanowski, 1987
Stephenson, Richard M.; Malanowski, Stanislaw,
Handbook of the Thermodynamics of Organic Compounds, 1987, https://doi.org/10.1007/978-94-009-3173-2
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Boublik, Fried, et al., 1984
Boublik, T.; Fried, V.; Hala, E.,
The Vapour Pressures of Pure Substances: Selected Values of the Temperature Dependence of the Vapour Pressures of Some Pure Substances in the Normal and Low Pressure Region, 2nd ed., Elsevier, New York, 1984, 972. [all data]
Cramer, 1943
Cramer, K.S.N.,
Chem. Zentr. II, 1943, 2234. [all data]
Mortimer and Murphy, 1923
Mortimer, F. Spencer.; Murphy, Ray v.,
The Vapor Pressures of Some Substances Found in Coal Tar.,
Ind. Eng. Chem., 1923, 15, 11, 1140-1142, https://doi.org/10.1021/ie50167a012
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Nass, Lenoir, et al., 1995
Nass, Karen; Lenoir, Dieter; Kettrup, Antonius,
Calculation of the Thermodynamic Properties of Polycyclic Aromatic Hydrocarbons by an Incremental Procedure,
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SATO, INOMATA, et al., 1986
SATO, NOBUYUKI; INOMATA, HIROSHI; ARAI, KUNIO; SAITO, SHOZABURO,
Measurement of vapor pressures for coal-related aromatic compounds by gas saturation method.,
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Sonnefeld, Zoller, et al., 1983
Sonnefeld, W.J.; Zoller, W.H.; May, W.E.,
Dynamic coupled-column liquid-chromatographic determination of ambient-temperature vapor pressures of polynuclear aromatic hydrocarbons,
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Radchenko and Kitaigorodskii, 1974
Radchenko, L.G.; Kitaigorodskii, A.I.,
The vapour pressures and heats of sublimation of naphthalene, biphenyl, octafluoronaphthalene, decafluorobiphenyl, acenaphthene and α-nitronaphthalene,
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Aihara, 1959
Aihara, A.,
Estimation of the energy of hydrogen bonds formed in crystals. I. Sublimation pressures of some organic molecular crystals and the additivity of lattice energy,
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Aihara, 1959, 2
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Estimation of the Energy of Hydrogen Bonds Formed in Crystals. I. Sublimation Pressures of Some Organic Molecular Crystals and the Additivity of Lattice Energy,
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Hoyer and Peperle, 1958
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Z. Elektrochem., 1958, 62, 61. [all data]
Sharma, Gupta, et al., 2008
Sharma, B.L.; Gupta, S.; Tandon, S.; Kant, R.,
Physico-mechanical properties of naphthalene--acenaphthene eutectic system by different modes of solidification,
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Domalski and Hearing, 1996
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Notes
Go To: Top, Condensed phase thermochemistry data, Phase change data, References
- Symbols used in this document:
Cp,solid Constant pressure heat capacity of solid S°solid,1 bar Entropy of solid at standard conditions (1 bar) Tboil Boiling point Tfus Fusion (melting) point Ttriple Triple point temperature ΔcH°solid Enthalpy of combustion of solid at standard conditions ΔfH°solid Enthalpy of formation of solid at standard conditions ΔfusH Enthalpy of fusion ΔfusS Entropy of fusion ΔsubH Enthalpy of sublimation ΔsubH° Enthalpy of sublimation at standard conditions ΔvapH Enthalpy of vaporization ΔvapH° Enthalpy of vaporization at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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