3,3,3-Trifluoro-1-propanol
- Formula: C3H5F3O
- Molecular weight: 114.0664
- IUPAC Standard InChIKey: HDBGBTNNPRCVND-UHFFFAOYSA-N
- CAS Registry Number: 2240-88-2
- 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: 3,3,3-Trifluoropropan-1-ol
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Gas phase thermochemistry data
Go To: Top, Condensed phase thermochemistry data, Mass spectrum (electron ionization), References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°gas | Cm | Andreevskii and Antonova, 1982 | uncertain value: -911.3 kJ/mol |
Condensed phase thermochemistry data
Go To: Top, Gas phase thermochemistry data, Mass spectrum (electron ionization), References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
ΔfH°liquid | -969.6 ± 1.6 | kJ/mol | Ccb | Kolesov, Ivanov, et al., 1969 | Reanalyzed by Pedley, Naylor, et al., 1986, Original value = -959.9 ± 1.6 kJ/mol; hf298_gas[kcal/mol]=-220.14±0.59; Kolesov and Kozina, 1986 |
Quantity | Value | Units | Method | Reference | Comment |
ΔcH°liquid | -1462.6 ± 1.6 | kJ/mol | Ccb | Kolesov, Ivanov, et al., 1969 | hf298_gas[kcal/mol]=-220.14±0.59; Kolesov and Kozina, 1986 |
Mass spectrum (electron ionization)
Go To: Top, Gas phase thermochemistry data, 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 by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
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Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | A. Musjce, AT&T Bell Labs., Murray Hill, N.J., USA |
NIST MS number | 142848 |
References
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Mass spectrum (electron ionization), Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Andreevskii and Antonova, 1982
Andreevskii, D.N.; Antonova, Z.A.,
Development of an increment scheme for calculating the thermodynamic properties of organic polyfluoro compounds,
J. Appl. Chem. USSR, 1982, 55, 582-587. [all data]
Kolesov, Ivanov, et al., 1969
Kolesov, V.I.; Ivanov, L.S.; Skuratov, S.M.,
Standard enthalpies of formation of some fluoropropanoles,
Dokl. Akad. Nauk SSSR, 1969, 184, 857-859. [all data]
Pedley, Naylor, et al., 1986
Pedley, J.B.; Naylor, R.D.; Kirby, S.P.,
Thermochemical Data of Organic Compounds, Chapman and Hall, New York, 1986, 1-792. [all data]
Kolesov and Kozina, 1986
Kolesov, V.P.; Kozina, M.P.,
Thermochemistry of organic and organohalogen compounds,
Russ. Chem. Rev., 1986, 55, 912. [all data]
Notes
Go To: Top, Gas phase thermochemistry data, Condensed phase thermochemistry data, Mass spectrum (electron ionization), References
- Symbols used in this document:
ΔcH°liquid Enthalpy of combustion of liquid at standard conditions ΔfH°gas Enthalpy of formation of gas at standard conditions ΔfH°liquid Enthalpy of formation of liquid at standard conditions - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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