- InChI
- InChI=1S/C11H15F7O2/c1-5(2)7(6(3)4)20-8(19)9(12,13)10(14,15)11(16,17)18/h5-7H,1-4H3
- InChI Key
- LFQPNHZMJJVTGX-UHFFFAOYSA-N
- Formula
- C11H15F7O2
- SMILES
-
CC(C)C(OC(=O)C(F)(F)C(F)(F)C(F
)(F)F)C(C)C - Molecular Weight1
- 312.22
- 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° | -1554.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1930.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 38.47 | kJ/mol | Joback Calculated Property |
| log10WS | -4.21 | Crippen Calculated Property | |
| logPoct/wat | 4.043 | Crippen Calculated Property | |
| McVol | 185.680 | ml/mol | McGowan Calculated Property |
| Pc | 1649.77 | kPa | Joback Calculated Property |
| Inp | [918.00; 918.00] |
|
|
| Inp | 918.00 | NIST | |
| Inp | 918.00 | NIST | |
| Tboil | 511.25 | K | Joback Calculated Property |
| Tc | 667.00 | K | Joback Calculated Property |
| Tfus | 252.28 | K | Joback Calculated Property |
| Vc | 0.750 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [481.57; 556.52] | J/mol×K | [511.25; 667.00] |
|
| Cp,gas | 481.57 | J/mol×K | 511.25 | Joback Calculated Property |
| Cp,gas | 495.93 | J/mol×K | 537.21 | Joback Calculated Property |
| Cp,gas | 509.50 | J/mol×K | 563.17 | Joback Calculated Property |
| Cp,gas | 522.31 | J/mol×K | 589.12 | Joback Calculated Property |
| Cp,gas | 534.39 | J/mol×K | 615.08 | Joback Calculated Property |
| Cp,gas | 545.78 | J/mol×K | 641.04 | Joback Calculated Property |
| Cp,gas | 556.52 | J/mol×K | 667.00 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-Dimethyl-3-pentanol, heptafluorobutyrate.
Sources
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