- InChI
- InChI=1S/C30H45F5O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-38-28(36)30(5-2,6-3)29(37)39-21-22-23(31)25(33)27(35)26(34)24(22)32/h4-21H2,1-3H3
- InChI Key
- GFHMOQHWIVKKMU-UHFFFAOYSA-N
- Formula
- C30H45F5O4
- SMILES
-
CCCCCCCCCCCCCCCCOC(=O)C(CC)(CC
)C(=O)OCc1c(F)c(F)c(F)c(F)c1F - Molecular Weight1
- 564.67
- 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° | -1173.07 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1962.25 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 79.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.89 | kJ/mol | Joback Calculated Property |
| log10WS | -11.12 | Crippen Calculated Property | |
| logPoct/wat | 9.256 | Crippen Calculated Property | |
| McVol | 433.530 | ml/mol | McGowan Calculated Property |
| Pc | 638.98 | kPa | Joback Calculated Property |
| Inp | [2953.00; 2953.00] |
|
|
| Inp | 2953.00 | NIST | |
| Inp | 2953.00 | NIST | |
| Tboil | 1083.08 | K | Joback Calculated Property |
| Tc | 1367.58 | K | Joback Calculated Property |
| Tfus | 666.57 | K | Joback Calculated Property |
| Vc | 1.734 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1525.73; 1607.77] | J/mol×K | [1083.08; 1367.58] |
|
| Cp,gas | 1525.73 | J/mol×K | 1083.08 | Joback Calculated Property |
| Cp,gas | 1545.18 | J/mol×K | 1130.50 | Joback Calculated Property |
| Cp,gas | 1562.14 | J/mol×K | 1177.91 | Joback Calculated Property |
| Cp,gas | 1576.74 | J/mol×K | 1225.33 | Joback Calculated Property |
| Cp,gas | 1589.11 | J/mol×K | 1272.75 | Joback Calculated Property |
| Cp,gas | 1599.41 | J/mol×K | 1320.16 | Joback Calculated Property |
| Cp,gas | 1607.77 | J/mol×K | 1367.58 | Joback Calculated Property |
Similar Compounds
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Sources
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