- InChI
- InChI=1S/C17H21FO4/c18-14-8-4-5-9-15(14)22-17(20)11-10-16(19)21-12-13-6-2-1-3-7-13/h4-5,8-9,13H,1-3,6-7,10-12H2
- InChI Key
- UOTRLGPJLZIDMM-UHFFFAOYSA-N
- Formula
- C17H21FO4
- SMILES
-
O=C(CCC(=O)Oc1ccccc1F)OCC1CCCC
C1 - Molecular Weight1
- 308.34
- 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° | -443.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -800.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.30 | kJ/mol | Joback Calculated Property |
| log10WS | -4.40 | Crippen Calculated Property | |
| logPoct/wat | 3.635 | Crippen Calculated Property | |
| McVol | 232.420 | ml/mol | McGowan Calculated Property |
| Pc | 1920.30 | kPa | Joback Calculated Property |
| Inp | [2226.00; 2226.00] |
|
|
| Inp | 2226.00 | NIST | |
| Inp | 2226.00 | NIST | |
| Tboil | 791.42 | K | Joback Calculated Property |
| Tc | 1009.64 | K | Joback Calculated Property |
| Tfus | 472.58 | K | Joback Calculated Property |
| Vc | 0.878 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [706.12; 784.49] | J/mol×K | [791.42; 1009.64] |
|
| Cp,gas | 706.12 | J/mol×K | 791.42 | Joback Calculated Property |
| Cp,gas | 722.45 | J/mol×K | 827.79 | Joback Calculated Property |
| Cp,gas | 737.45 | J/mol×K | 864.16 | Joback Calculated Property |
| Cp,gas | 751.12 | J/mol×K | 900.53 | Joback Calculated Property |
| Cp,gas | 763.51 | J/mol×K | 936.90 | Joback Calculated Property |
| Cp,gas | 774.62 | J/mol×K | 973.27 | Joback Calculated Property |
| Cp,gas | 784.49 | J/mol×K | 1009.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, cyclohexylmethyl 2-fluorophenyl ester.
Sources
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