- InChI
- InChI=1S/C7H7F5O4/c1-5(2,3(13)14)16-4(15)6(8,9)7(10,11)12/h1-2H3,(H,13,14)
- InChI Key
- IRMICLOUXGUURA-UHFFFAOYSA-N
- Formula
- C7H7F5O4
- SMILES
-
CC(C)(OC(=O)C(F)(F)C(F)(F)F)C(
=O)O - Molecular Weight1
- 250.12
- 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).
- Inp : Non-polar retention indices.
- 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° | -1457.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1704.22 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.78 | kJ/mol | Joback Calculated Property |
| log10WS | -1.80 | Crippen Calculated Property | |
| logPoct/wat | 1.590 | Crippen Calculated Property | |
| McVol | 133.220 | ml/mol | McGowan Calculated Property |
| Pc | 2899.85 | kPa | Joback Calculated Property |
| Inp | 1005.00 | NIST | |
| Tboil | 568.56 | K | Joback Calculated Property |
| Tc | 736.53 | K | Joback Calculated Property |
| Tfus | 361.77 | K | Joback Calculated Property |
| Vc | 0.533 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [355.10; 397.61] | J/mol×K | [568.56; 736.53] | 
|
| Cp,gas | 355.10 | J/mol×K | 568.56 | Joback Calculated Property |
| Cp,gas | 363.58 | J/mol×K | 596.55 | Joback Calculated Property |
| Cp,gas | 371.45 | J/mol×K | 624.55 | Joback Calculated Property |
| Cp,gas | 378.76 | J/mol×K | 652.54 | Joback Calculated Property |
| Cp,gas | 385.53 | J/mol×K | 680.54 | Joback Calculated Property |
| Cp,gas | 391.80 | J/mol×K | 708.53 | Joback Calculated Property |
| Cp,gas | 397.61 | J/mol×K | 736.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to «alpha»-Hydroxyisobutyric acid, pentafluoropropionate.
Sources
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