- InChI
- InChI=1S/C14H13F5O2/c15-9-10(16)12(18)14(13(19)11(9)17)21-8(20)6-5-7-3-1-2-4-7/h7H,1-6H2
- InChI Key
- UOWZPDYHJCKUMA-UHFFFAOYSA-N
- Formula
- C14H13F5O2
- SMILES
-
O=C(CCC1CCCC1)Oc1c(F)c(F)c(F)c
(F)c1F - Molecular Weight1
- 308.24
- 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° | -1040.16 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1317.98 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 57.67 | kJ/mol | Joback Calculated Property |
| log10WS | -5.61 | Crippen Calculated Property | |
| logPoct/wat | 4.258 | Crippen Calculated Property | |
| McVol | 189.790 | ml/mol | McGowan Calculated Property |
| Pc | 1882.17 | kPa | Joback Calculated Property |
| Inp | 1578.00 | NIST | |
| Tboil | 659.22 | K | Joback Calculated Property |
| Tc | 847.07 | K | Joback Calculated Property |
| Tfus | 422.57 | K | Joback Calculated Property |
| Vc | 0.766 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [521.37; 593.90] | J/mol×K | [659.22; 847.07] | 
|
| Cp,gas | 521.37 | J/mol×K | 659.22 | Joback Calculated Property |
| Cp,gas | 535.33 | J/mol×K | 690.53 | Joback Calculated Property |
| Cp,gas | 548.52 | J/mol×K | 721.84 | Joback Calculated Property |
| Cp,gas | 560.97 | J/mol×K | 753.15 | Joback Calculated Property |
| Cp,gas | 572.67 | J/mol×K | 784.45 | Joback Calculated Property |
| Cp,gas | 583.65 | J/mol×K | 815.76 | Joback Calculated Property |
| Cp,gas | 593.90 | J/mol×K | 847.07 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Cyclopentylpropionic acid, pentafluorophenyl ester.
Sources
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