- InChI
- InChI=1S/C18H23FO4/c1-2-3-12-22-17(20)13-8-4-5-9-14(13)18(21)23-16-11-7-6-10-15(16)19/h6-7,10-11,13-14H,2-5,8-9,12H2,1H3
- InChI Key
- CZGWOQFCRZVISW-UHFFFAOYSA-N
- Formula
- C18H23FO4
- SMILES
-
CCCCOC(=O)C1CCCCC1C(=O)Oc1cccc
c1F - Molecular Weight1
- 322.37
- 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).
- 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° | -442.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -841.52 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.22 | kJ/mol | Joback Calculated Property |
| log10WS | -4.58 | Crippen Calculated Property | |
| logPoct/wat | 3.881 | Crippen Calculated Property | |
| McVol | 246.510 | ml/mol | McGowan Calculated Property |
| Pc | 1720.31 | kPa | Joback Calculated Property |
| Tboil | 809.63 | K | Joback Calculated Property |
| Tc | 1025.48 | K | Joback Calculated Property |
| Tfus | 479.61 | K | Joback Calculated Property |
| Vc | 0.933 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [766.97; 847.17] | J/mol×K | [809.63; 1025.48] | 
|
| Cp,gas | 766.97 | J/mol×K | 809.63 | Joback Calculated Property |
| Cp,gas | 783.79 | J/mol×K | 845.60 | Joback Calculated Property |
| Cp,gas | 799.21 | J/mol×K | 881.58 | Joback Calculated Property |
| Cp,gas | 813.23 | J/mol×K | 917.55 | Joback Calculated Property |
| Cp,gas | 825.89 | J/mol×K | 953.53 | Joback Calculated Property |
| Cp,gas | 837.20 | J/mol×K | 989.50 | Joback Calculated Property |
| Cp,gas | 847.17 | J/mol×K | 1025.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, butyl 2-fluorophenyl ester.
Sources
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