- InChI
- InChI=1S/C3H2F6O/c4-2(5,6)1(10)3(7,8)9/h1,10H
- InChI Key
- BYEAHWXPCBROCE-UHFFFAOYSA-N
- Formula
- C3H2F6O
- SMILES
- OC(C(F)(F)F)C(F)(F)F
- Molecular Weight1
- 168.04
- CAS
- 920-66-1
- Other Names
-
- 1,1,1,3,3,3-Hexafluoro-2-hydroxypropane
- 1,1,1,3,3,3-Hexafluoropropan-2-ol
- 1,1,1,3,3,3-Hexafluoropropanol
- 1,1,1,3,3,3-hexafluoro-2-propanol
- 1,1,1,3,3,3-hexafluoroisopropanol
- 1,1,1,3,3,3-hexafluoroisopropyl alcohol
- 2,2,2-Trifluoro-1-(trifluoromethyl)ethanol
- 2H-Hexafluoroisopropanol
- Bis(trifluoromethyl)methanol
- CF3CH(OH)CF3
- Ethanol, 2,2,2-trifluoro-1-(trifluoromethyl)-
- HFIP
- Hexafluoro-2-propanol
- Hexafluoroisopropanol
- Hexafluoroisopropyl alcohol
- NSC 96336
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pvap : Vapor pressure (kPa).
- ρl : Liquid Density (kg/m3).
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| PAff | 686.60 | kJ/mol | NIST |
| BasG | 656.20 | kJ/mol | NIST |
| ΔfusH° | 7.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [41.58; 41.60] | kJ/mol |
|
| ΔvapH° | 41.58 | kJ/mol | NIST |
| ΔvapH° | 41.60 | kJ/mol | NIST |
| IE | [11.94; 12.23] | eV |
|
| IE | 11.94 | eV | NIST |
| IE | 12.23 | eV | NIST |
| log10WS | -0.98 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.472 | Crippen Calculated Property | |
| McVol | 69.620 | ml/mol | McGowan Calculated Property |
| Tboil | [331.00; 332.20] | K |
|
| Tboil | 331.00 | K | NIST |
| Tboil | 332.20 | K | NIST |
| Tfus | 270.15 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔvapH | [40.20; 47.30] | kJ/mol | [284.50; 312.00] |
|
| ΔvapH | 47.30 | kJ/mol | 284.50 | NIST |
| ΔvapH | 40.20 | kJ/mol | 312.00 | NIST |
| ρl | 1604.84 | kg/m3 | 298.15 | Liquid Liquid Equilibria in Ternary Systems of Hexafluoroisopropanol + Perfluorocarbon + Water or Methanol at 298.15 K |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [127.58; 238.67] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -8.63000e+00 | |||
| Coefficient B | 6.51100e-01 | |||
| Coefficient C | -6.15000e-04 | |||
| Coefficient D | 2.11200e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 127.58 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 154.09 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 175.50 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 192.48 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 205.70 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 215.81 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 223.50 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 229.43 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 234.26 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 238.67 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.62] | kPa | [255.86; 349.50] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.72410e+01 | |||
| Coefficient B | -3.76991e+03 | |||
| Coefficient C | -3.34880e+01 | |||
| Temperature range, min. | 255.86 | |||
| Temperature range, max. | 349.50 | |||
| Pvap | 1.33 | kPa | 255.86 | Calculated Property |
| Pvap | 2.85 | kPa | 266.26 | Calculated Property |
| Pvap | 5.69 | kPa | 276.67 | Calculated Property |
| Pvap | 10.75 | kPa | 287.07 | Calculated Property |
| Pvap | 19.31 | kPa | 297.48 | Calculated Property |
| Pvap | 33.18 | kPa | 307.88 | Calculated Property |
| Pvap | 54.81 | kPa | 318.29 | Calculated Property |
| Pvap | 87.39 | kPa | 328.69 | Calculated Property |
| Pvap | 134.99 | kPa | 339.10 | Calculated Property |
| Pvap | 202.62 | kPa | 349.50 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO-.
Mixtures
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Hydrogen + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Nitrogen + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Oxygen + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Methane + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Ethane + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Ethylene + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Tetrafluoromethane + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Sulfur hexafluoride + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Carbon dioxide + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + helium + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Argon + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Krypton + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Xenon + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + neon + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Hexane, tetradecafluoro- + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Perfluoro(methylcyclohexane) + Water
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Hexane, tetradecafluoro- + Methyl Alcohol
- 2-PROPANOL, 1,1,1,3,3,3-HEXAFLUORO- + Perfluoro(methylcyclohexane) + Methyl Alcohol
Sources
- Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Solubility of gases in fluoroorganic alcohols. Part II. Solubilities of noble gases in (water + 1,1,1,3,3,3-hexafluoropropan-2-ol) at 298.15 K and 101.33 kPa
- Solubility of gases in fluoroorganic alcohols. Part III. Solubilities of several non-polar gases in water + 1,1,1,3,3,3-hexafluoropropan-2-ol at 298.15 K and 101.33 kPa
- Liquid Liquid Equilibria in Ternary Systems of Hexafluoroisopropanol + Perfluorocarbon + Water or Methanol at 298.15 K
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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