- InChI
- InChI=1S/C10H11F7O4/c1-4(2)3-5(6(18)19)21-7(20)8(11,12)9(13,14)10(15,16)17/h4-5H,3H2,1-2H3,(H,18,19)
- InChI Key
- GGSQFGBRSVUXHW-UHFFFAOYSA-N
- Formula
- C10H11F7O4
- SMILES
-
CC(C)CC(OC(=O)C(F)(F)C(F)(F)C(
F)(F)F)C(=O)O - Molecular Weight1
- 328.18
- 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° | -1826.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2168.92 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.05 | kJ/mol | Joback Calculated Property |
| log10WS | -3.13 | Crippen Calculated Property | |
| logPoct/wat | 2.862 | Crippen Calculated Property | |
| McVol | 179.030 | ml/mol | McGowan Calculated Property |
| Pc | 2030.89 | kPa | Joback Calculated Property |
| Inp | 1200.00 | NIST | |
| Tboil | 634.86 | K | Joback Calculated Property |
| Tc | 795.77 | K | Joback Calculated Property |
| Tfus | 366.76 | K | Joback Calculated Property |
| Vc | 0.726 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [513.88; 564.50] | J/mol×K | [634.86; 795.77] | 
|
| Cp,gas | 513.88 | J/mol×K | 634.86 | Joback Calculated Property |
| Cp,gas | 523.80 | J/mol×K | 661.68 | Joback Calculated Property |
| Cp,gas | 533.09 | J/mol×K | 688.50 | Joback Calculated Property |
| Cp,gas | 541.77 | J/mol×K | 715.32 | Joback Calculated Property |
| Cp,gas | 549.87 | J/mol×K | 742.14 | Joback Calculated Property |
| Cp,gas | 557.44 | J/mol×K | 768.95 | Joback Calculated Property |
| Cp,gas | 564.50 | J/mol×K | 795.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Hydroxyisocaproic acid, heptafluorobutyrate.
Sources
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