- InChI
- InChI=1S/C30H49FO4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-22-25-34-28(32)30(5-2,6-3)29(33)35-27-24-21-20-23-26(27)31/h20-21,23-24H,4-19,22,25H2,1-3H3
- InChI Key
- IWRDUVBECOFNTL-UHFFFAOYSA-N
- Formula
- C30H49FO4
- SMILES
-
CCCCCCCCCCCCCCCCCOC(=O)C(CC)(C
C)C(=O)Oc1ccccc1F - Molecular Weight1
- 492.71
- 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° | -355.31 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1131.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 68.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 101.51 | kJ/mol | Joback Calculated Property |
| log10WS | -9.95 | Crippen Calculated Property | |
| logPoct/wat | 8.952 | Crippen Calculated Property | |
| McVol | 426.450 | ml/mol | McGowan Calculated Property |
| Pc | 724.18 | kPa | Joback Calculated Property |
| Inp | 3215.00 | NIST | |
| Tboil | 1066.08 | K | Joback Calculated Property |
| Tc | 1317.90 | K | Joback Calculated Property |
| Tfus | 614.13 | K | Joback Calculated Property |
| Vc | 1.663 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1503.29; 1593.76] | J/mol×K | [1066.08; 1317.90] | 
|
| Cp,gas | 1503.29 | J/mol×K | 1066.08 | Joback Calculated Property |
| Cp,gas | 1522.47 | J/mol×K | 1108.05 | Joback Calculated Property |
| Cp,gas | 1539.84 | J/mol×K | 1150.02 | Joback Calculated Property |
| Cp,gas | 1555.53 | J/mol×K | 1191.99 | Joback Calculated Property |
| Cp,gas | 1569.65 | J/mol×K | 1233.96 | Joback Calculated Property |
| Cp,gas | 1582.35 | J/mol×K | 1275.93 | Joback Calculated Property |
| Cp,gas | 1593.76 | J/mol×K | 1317.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2-fluorophenyl heptadecyl ester.
Sources
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