Triacetin

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Phase change data

Go To: Top, IR Spectrum, Gas Chromatography, 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
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
Tboil520. ± 70.KAVGN/AAverage of 6 values; Individual data points
Quantity Value Units Method Reference Comment
Tfus195.KN/AHutchings, Nicklasson, et al., 1993Glass phase; Uncertainty assigned by TRC = 10. K; Presumably this is glass transition temp.; TRC
Tfus277.15KN/AYumashev, Demchenko, et al., 1984Uncertainty assigned by TRC = 0.8 K; TRC
Tfus277.3KN/ABaur, 1954Uncertainty assigned by TRC = 0.5 K; TRC
Tfus276.4KN/AHancock, Sylvester, et al., 1948Uncertainty assigned by TRC = 2. K; Tends to undercool to form a glass at -60 to -78 C. Crystalization can be induced by seeding; TRC
Tfus213.KN/ATimmermans, 1922Uncertainty assigned by TRC = 50. K; presumably this is the glass transition temp.; TRC
Quantity Value Units Method Reference Comment
Ttriple275.25KN/ARabinovich, Khlyustova, et al., 1983Uncertainty assigned by TRC = 0.02 K; TRC
Quantity Value Units Method Reference Comment
Δvap20.0 ± 0.7kcal/molAVGN/AAverage of 6 values; Individual data points

Enthalpy of vaporization

ΔvapH (kcal/mol) Temperature (K) Method Reference Comment
19.6299.AStephenson and Malanowski, 1987Based on data from 284. to 319. K. See also Woodman and Adicoff, 1963.; AC

Enthalpy of fusion

ΔfusH (kcal/mol) Temperature (K) Reference Comment
6.1663275.25Rabinovich, Khlyustova, et al., 1983, 2DH
6.17275.3Domalski and Hearing, 1996AC

Entropy of fusion

ΔfusS (cal/mol*K) Temperature (K) Reference Comment
22.4275.25Rabinovich, Khlyustova, et al., 1983, 2DH

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:


IR Spectrum

Go To: Top, Phase change data, Gas Chromatography, References, Notes

Data compiled by: Coblentz Society, Inc.

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


Gas Chromatography

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

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
CapillaryOV-101200.1285.Adam, 1981Column length: 50. m

Kovats' RI, non-polar column, temperature ramp

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Column type Active phase I Reference Comment
PackedOV-1011348.Alley and Dykes, 19726. K/min; Tstart: 70. C; Tend: 220. C

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

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Column type Active phase I Reference Comment
PackedSE-301282.Ramsey, Lee, et al., 1980He, Chromosorb G HP (80-100 mesh); Column length: 1.5 m; Program: not specified

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

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Column type Active phase I Reference Comment
CapillaryHP-51344.David, Scanlan, et al., 200050. m/0.32 mm/1.05 μm, He, 2. K/min; Tstart: 50. C; Tend: 290. C
CapillaryDB-11306.Flath, Light, et al., 199050. C @ 0.1 min, 4. K/min; Column length: 60. m; Column diameter: 0.32 mm; Tend: 250. C

Normal alkane RI, non-polar column, isothermal

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Column type Active phase Temperature (C) I Reference Comment
CapillaryOV-101110.1313.Leol'ko, Krasnykh, et al., 2007He; Column length: 30. m; Column diameter: 0.25 mm
CapillaryOV-101120.1310.Leol'ko, Krasnykh, et al., 2007He; Column length: 30. m; Column diameter: 0.25 mm
CapillaryOV-101130.1308.Leol'ko, Krasnykh, et al., 2007He; Column length: 30. m; Column diameter: 0.25 mm
CapillaryOV-101140.1305.Leol'ko, Krasnykh, et al., 2007He; Column length: 30. m; Column diameter: 0.25 mm

Normal alkane RI, non-polar column, temperature ramp

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Column type Active phase I Reference Comment
CapillaryHP-51350.N/A30. m/0.32 mm/0.25 μm, Helium, 40. C @ 2. min, 5. K/min, 250. C @ 5. min

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

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Column type Active phase I Reference Comment
CapillarySLB-5 MS1339.Mondello, 201230. m/0.25 mm/0.25 μm, Helium; Program: not specified
CapillarySLB-5 MS1346.Mondello, 201230. m/0.25 mm/0.25 μm, Helium; Program: not specified
CapillaryHP-51344.4David, Scanlan, et al., 200250. m/0.32 mm/1.05 μm, He; Program: not specified
OtherMethyl Silicone1282.Ardrey and Moffat, 1981Program: not specified

Normal alkane RI, polar column, temperature ramp

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Column type Active phase I Reference Comment
CapillaryZB-Wax2077.N/A30. m/0.32 mm/0.25 μm, Helium, 40. C @ 2. min, 5. K/min, 250. C @ 5. min

Normal alkane RI, polar column, custom temperature program

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Column type Active phase I Reference Comment
CapillaryStabilwax2103.Chinnici, Guerrero, et al., 200930. m/0.25 mm/0.25 μm, Helium; Program: 35 0C 3 0C/min -> 100 0C 5 0C/min -> 240 0C (10 min)
CapillaryCarbowax 20M2029.Vinogradov, 2004Program: not specified

References

Go To: Top, Phase change data, IR Spectrum, Gas Chromatography, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Hutchings, Nicklasson, et al., 1993
Hutchings, D.; Nicklasson, M.; Sakr, A.A., Pharazie, 1993, 38, 912-4. [all data]

Yumashev, Demchenko, et al., 1984
Yumashev, N.V.; Demchenko, M.D.; Libov, V.S.; Miroshnichenko, E.; Perova, T.S.; Agich, A.A., Zh. Obshch. Khim., 1984, 54, 743-7. [all data]

Baur, 1954
Baur, F.J., J. Phys. Chem., 1954, 58, 380. [all data]

Hancock, Sylvester, et al., 1948
Hancock, B.; Sylvester, D.M.; Forman, S.E., Crystalization fo Triacetin, J. Am. Chem. Soc., 1948, 70, 425. [all data]

Timmermans, 1922
Timmermans, J., Investigation of the Freezing Point of Organic Substances VII, Bull. Soc. Chim. Belg., 1922, 31, 389. [all data]

Rabinovich, Khlyustova, et al., 1983
Rabinovich, I.B.; Khlyustova, T.B.; Mochalov, A.N.; Kokurina, N.Y., The Heat Capacity and Thermodynamic Properties of Triacetin in the Temperature Rante 0 - 320 K, Zh. Fiz. Khim., 1983, 57, 2867. [all data]

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 . [all data]

Woodman and Adicoff, 1963
Woodman, A.L.; Adicoff, A., Vapor pressure of triacetin, triethylene glycol dinitrte, and metriol trinitrate, J. Chem. Eng. Data, 1963, 8, 241-242. [all data]

Rabinovich, Khlyustova, et al., 1983, 2
Rabinovich, I.B.; Khlyustova, T.B.; Mochalov, A.N.; Kokurina, N.Yu., The heat capacity and thermodynamic properties of triacetin in the temperature range 0-320 K, Zhur. Fiz. Khim., 1983, 57, 2867-2869. [all data]

Domalski and Hearing, 1996
Domalski, Eugene S.; Hearing, Elizabeth D., Heat Capacities and Entropies of Organic Compounds in the Condensed Phase. Volume III, J. Phys. Chem. Ref. Data, 1996, 25, 1, 1, https://doi.org/10.1063/1.555985 . [all data]

Adam, 1981
Adam, S., Separation of mono- and di-saccharide derivatives by high-resolution gas chromatography, Z. Lebensm. Unters. Forsch., 1981, 173, 2, 109-112, https://doi.org/10.1007/BF01042273 . [all data]

Alley and Dykes, 1972
Alley, B.J.; Dykes, H.W.H., Gas-Liquid Chromatographic Determination of Nitrate Esters,Stabilizers and Plasticizers in Nitrocellulose-Base Propellants, J. Chromatogr., 1972, 71, 1, 23-37, https://doi.org/10.1016/S0021-9673(01)85687-9 . [all data]

Ramsey, Lee, et al., 1980
Ramsey, J.D.; Lee, T.D.; Osselton, M.D.; Moffat, A.C., Gas-liquid chromatographic retention indices of 296 non-drug substances on SE-30 or OV-1 likely to be encountered in toxicological analyses, J. Chromatogr., 1980, 184, 2, 185-206, https://doi.org/10.1016/S0021-9673(00)85641-1 . [all data]

David, Scanlan, et al., 2000
David, F.; Scanlan, F.; Sandra, P., Retention time locking in flavor analysis, Proceedings 23rd ISCC; CD-ROM, 2000, retrieved from http://www.richrom.com/assets/CD23PDF. [all data]

Flath, Light, et al., 1990
Flath, R.A.; Light, D.M.; Jang, E.B.; Mon, T.R.; John, J.O., Headspace Examination of Volatile Emissions from Ripening Papaya (Carica papaya L., Solo Variety), J. Agric. Food Chem., 1990, 38, 4, 1060-1063, https://doi.org/10.1021/jf00094a032 . [all data]

Leol'ko, Krasnykh, et al., 2007
Leol'ko, A.S.; Krasnykh, E.L.; Levanova, S.L.; Kukushkin, I.K., Synthesis and identification of glycerol esters, Izv. Vyssh. Uchebn. Zaved. Khim. Khim. Tekhnol., 2007, 50, 4, 125-127. [all data]

Mondello, 2012
Mondello, L., HS-SPME-GCxGC-MS analysis of Yerba Mate (Ilex paraguariensis) in Shimadzu GC-GC application compendium of comprehensive 2D GC, Vol. 1-5, Shimadzu Corp., 2012, 1-29. [all data]

David, Scanlan, et al., 2002
David, F.; Scanlan, F.; Sandra, P.; Szelewski, M., Analysis of essential oil compounds using retention time locked methods and retention time databases, 2002, retrieved from http://www.chem.agilent.com. [all data]

Ardrey and Moffat, 1981
Ardrey, R.E.; Moffat, A.C., Gas-liquid chromatographic retention indices of 1318 substances of toxicological interest on SE-30 or OV-1 stationary phase, J. Chromatogr., 1981, 220, 3, 195-252, https://doi.org/10.1016/S0021-9673(00)81925-1 . [all data]

Chinnici, Guerrero, et al., 2009
Chinnici, F.; Guerrero, E.D.; Sonni, F.; Natali, N.; Marin, R.N.; Riponi, C., Gas chromatography - mass spectrometry (GC-MS) characterization of volatile compounds in quality vinegars with protected Europian geographical indication, J. Agric. Food Chem., 2009, 57, 11, 4784-4792, https://doi.org/10.1021/jf804005w . [all data]

Vinogradov, 2004
Vinogradov, B.A., Production, composition, properties and application of essential oils, 2004, retrieved from http://viness.narod.ru. [all data]


Notes

Go To: Top, Phase change data, IR Spectrum, Gas Chromatography, References