- InChI
- InChI=1S/C4H7F3O/c1-3(2,8)4(5,6)7/h8H,1-2H3
- InChI Key
- OCGWWLDZAFOHGD-UHFFFAOYSA-N
- Formula
- C4H7F3O
- SMILES
- CC(C)(O)C(F)(F)F
- Molecular Weight1
- 128.09
- CAS
- 507-52-8
- Other Names
-
- 2-Trifluoromethylpropanol-2
- 2-Propanol, 1,1,1-trifluoro-2-methyl-
- 1,1,1-trifluoro-2-methylpropan-2-ol
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -732.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -883.95 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 4.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 36.13 | kJ/mol | Joback Calculated Property |
| log10WS | -1.53 | Crippen Calculated Property | |
| logPoct/wat | 1.320 | Crippen Calculated Property | |
| McVol | 78.400 | ml/mol | McGowan Calculated Property |
| Pc | 3872.29 | kPa | Joback Calculated Property |
| Tboil | 353.50 ± 0.50 | K | NIST |
| Tc | 530.70 | K | Joback Calculated Property |
| Tfus | 202.27 | K | Joback Calculated Property |
| Vc | 0.310 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [162.14; 205.06] | J/mol×K | [374.45; 530.70] | 
|
| Cp,gas | 162.14 | J/mol×K | 374.45 | Joback Calculated Property |
| Cp,gas | 170.47 | J/mol×K | 400.49 | Joback Calculated Property |
| Cp,gas | 178.30 | J/mol×K | 426.53 | Joback Calculated Property |
| Cp,gas | 185.66 | J/mol×K | 452.57 | Joback Calculated Property |
| Cp,gas | 192.55 | J/mol×K | 478.61 | Joback Calculated Property |
| Cp,gas | 199.01 | J/mol×K | 504.65 | Joback Calculated Property |
| Cp,gas | 205.06 | J/mol×K | 530.70 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Trifluoromethyl-2-propanol.
Sources
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