2,2,3,3-Tetrafluoro-1-propanol
- Formula: C3H4F4O
- Molecular weight: 132.0569
- IUPAC Standard InChIKey: NBUKAOOFKZFCGD-UHFFFAOYSA-N
- CAS Registry Number: 76-37-9
- 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. - Other names: 1H,1H,3H-Tetrafluoro-1-propanol; 2,2,3,3-Tetrafluoro-propanol-1; 1-Propanol, 2,2,3,3-tetrafluoro-; 1,1,3-Trihydroperfluoro-1-propanol; 2,2,3,3-Tetrafluoropropyl alcohol; 2,2,3,3-Tetrafluoropropanol; 1,1,3H-perfluoropropanol; 2,2,3,3-tetrafluoropropan-1-ol
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Phase change data
Go To: Top, Henry's Law data, Gas phase ion energetics 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
ALS - Hussein Y. Afeefy, Joel F. Liebman, and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos
Quantity | Value | Units | Method | Reference | Comment |
---|---|---|---|---|---|
Tboil | 382. to 383. | K | N/A | PCR Inc., 1990 | BS |
Tboil | 382.7 | K | N/A | Weast and Grasselli, 1989 | BS |
Quantity | Value | Units | Method | Reference | Comment |
ΔvapH° | 12.81 | kcal/mol | V | Rochester and Symonds, 1973 | ALS |
ΔvapH° | 12.8 | kcal/mol | MM | Rochester and Symonds, 1973 | Based on data from 298. to 333. K.; AC |
Enthalpy of vaporization
ΔvapH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
11.4 | 318. | A | Stephenson and Malanowski, 1987 | Based on data from 303. to 380. K.; AC |
12.0 | 313. | MM | Rochester and Symonds, 1973 | Based on data from 298. to 333. K.; AC |
Henry's Law data
Go To: Top, Phase change data, Gas phase ion energetics 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: Rolf Sander
Henry's Law constant (water solution)
kH(T) = k°H exp(d(ln(kH))/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(kH))/d(1/T) = Temperature dependence constant (K)
k°H (mol/(kg*bar)) | d(ln(kH))/d(1/T) (K) | Method | Reference |
---|---|---|---|
160. | 6700. | M | N/A |
Gas phase ion energetics data
Go To: Top, Phase change data, Henry's Law 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: Sharon G. Lias and Joel F. Liebman
Ionization energy determinations
IE (eV) | Method | Reference | Comment |
---|---|---|---|
11.58 | PE | Zverev, Sinyashina, et al., 1990 | Vertical value |
References
Go To: Top, Phase change data, Henry's Law data, Gas phase ion energetics data, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
PCR Inc., 1990
PCR Inc.,
Research Chemicals Catalog 1990-1991, PCR Inc., Gainesville, FL, 1990, 1. [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]
Rochester and Symonds, 1973
Rochester, C.H.; Symonds, J.R.,
Thermodynamic studies of fluoroalchols Part 1.-Vapour pressures and enthalpies of vaporization,
J. Chem. Soc. Faraday Trans. 1, 1973, 69, 1267. [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]
Zverev, Sinyashina, et al., 1990
Zverev, V.V.; Sinyashina, T.N.; Mironov, V.F.,
Photoelectron spectra and electronic structures of organophosphorus compounds. IX. Fluorine-containing phosphites,
J. Gen. Chem. USSR, 1990, 60, 696. [all data]
Notes
Go To: Top, Phase change data, Henry's Law data, Gas phase ion energetics data, References
- Symbols used in this document:
Tboil Boiling point d(ln(kH))/d(1/T) Temperature dependence parameter for Henry's Law constant k°H Henry's Law constant at 298.15K 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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