- InChI
- InChI=1S/C25H37FO4/c1-2-3-4-5-6-7-8-9-14-19-29-24(27)20-15-10-11-16-21(20)25(28)30-23-18-13-12-17-22(23)26/h12-13,17-18,20-21H,2-11,14-16,19H2,1H3
- InChI Key
- ODKBUQDUYAWVPP-UHFFFAOYSA-N
- Formula
- C25H37FO4
- SMILES
-
CCCCCCCCCCCOC(=O)C1CCCCC1C(=O)
Oc1ccccc1F - Molecular Weight1
- 420.56
- 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° | -383.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -986.00 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.80 | kJ/mol | Joback Calculated Property |
| log10WS | -7.51 | Crippen Calculated Property | |
| logPoct/wat | 6.611 | Crippen Calculated Property | |
| McVol | 345.140 | ml/mol | McGowan Calculated Property |
| Pc | 1052.09 | kPa | Joback Calculated Property |
| Inp | 2931.00 | NIST | |
| Tboil | 969.79 | K | Joback Calculated Property |
| Tc | 1188.87 | K | Joback Calculated Property |
| Tfus | 558.50 | K | Joback Calculated Property |
| Vc | 1.325 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1187.55; 1262.14] | J/mol×K | [969.79; 1188.87] | 
|
| Cp,gas | 1187.55 | J/mol×K | 969.79 | Joback Calculated Property |
| Cp,gas | 1204.12 | J/mol×K | 1006.30 | Joback Calculated Property |
| Cp,gas | 1218.97 | J/mol×K | 1042.82 | Joback Calculated Property |
| Cp,gas | 1232.16 | J/mol×K | 1079.33 | Joback Calculated Property |
| Cp,gas | 1243.72 | J/mol×K | 1115.84 | Joback Calculated Property |
| Cp,gas | 1253.70 | J/mol×K | 1152.36 | Joback Calculated Property |
| Cp,gas | 1262.14 | J/mol×K | 1188.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, 2-fluorophenyl undecyl ester.
Sources
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