- InChI
- InChI=1S/C32H52F2O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-37-30(35)32(5-2,6-3)31(36)38-26-27-22-23-28(33)29(34)25-27/h22-23,25H,4-21,24,26H2,1-3H3
- InChI Key
- QBBHCSVTCXGJNV-UHFFFAOYSA-N
- Formula
- C32H52F2O4
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)C(CC)(
CC)C(=O)OCc1ccc(F)c(F)c1 - Molecular Weight1
- 538.75
- 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° | -542.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1380.79 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 76.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.81 | kJ/mol | Joback Calculated Property |
| log10WS | -10.96 | Crippen Calculated Property | |
| logPoct/wat | 9.619 | Crippen Calculated Property | |
| McVol | 456.400 | ml/mol | McGowan Calculated Property |
| Pc | 635.12 | kPa | Joback Calculated Property |
| Inp | 3371.00 | NIST | |
| Tboil | 1116.09 | K | Joback Calculated Property |
| Tc | 1401.90 | K | Joback Calculated Property |
| Tfus | 649.78 | K | Joback Calculated Property |
| Vc | 1.792 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1637.14; 1729.38] | J/mol×K | [1116.09; 1401.90] | 
|
| Cp,gas | 1637.14 | J/mol×K | 1116.09 | Joback Calculated Property |
| Cp,gas | 1657.64 | J/mol×K | 1163.72 | Joback Calculated Property |
| Cp,gas | 1675.83 | J/mol×K | 1211.36 | Joback Calculated Property |
| Cp,gas | 1691.91 | J/mol×K | 1258.99 | Joback Calculated Property |
| Cp,gas | 1706.06 | J/mol×K | 1306.63 | Joback Calculated Property |
| Cp,gas | 1718.49 | J/mol×K | 1354.26 | Joback Calculated Property |
| Cp,gas | 1729.38 | J/mol×K | 1401.90 | Joback Calculated Property |
Similar Compounds
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Sources
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