- InChI
- InChI=1S/C13H14F2O4/c14-8-9-18-12(16)6-3-7-13(17)19-11-5-2-1-4-10(11)15/h1-2,4-5H,3,6-9H2
- InChI Key
- OHLNBLHDDOVMST-UHFFFAOYSA-N
- Formula
- C13H14F2O4
- SMILES
- O=C(CCCC(=O)Oc1ccccc1F)OCCF
- Molecular Weight1
- 272.24
- 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° | -696.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -968.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.15 | kJ/mol | Joback Calculated Property |
| log10WS | -2.93 | Crippen Calculated Property | |
| logPoct/wat | 2.414 | Crippen Calculated Property | |
| McVol | 188.690 | ml/mol | McGowan Calculated Property |
| Pc | 2167.36 | kPa | Joback Calculated Property |
| Inp | [1806.00; 1806.00] |
|
|
| Inp | 1806.00 | NIST | |
| Inp | 1806.00 | NIST | |
| Tboil | 679.62 | K | Joback Calculated Property |
| Tc | 872.58 | K | Joback Calculated Property |
| Tfus | 420.71 | K | Joback Calculated Property |
| Vc | 0.740 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [503.53; 568.82] | J/mol×K | [679.62; 872.58] |
|
| Cp,gas | 503.53 | J/mol×K | 679.62 | Joback Calculated Property |
| Cp,gas | 516.27 | J/mol×K | 711.78 | Joback Calculated Property |
| Cp,gas | 528.25 | J/mol×K | 743.94 | Joback Calculated Property |
| Cp,gas | 539.50 | J/mol×K | 776.10 | Joback Calculated Property |
| Cp,gas | 550.00 | J/mol×K | 808.26 | Joback Calculated Property |
| Cp,gas | 559.77 | J/mol×K | 840.42 | Joback Calculated Property |
| Cp,gas | 568.82 | J/mol×K | 872.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2-fluorophenyl 2-fluoroethyl ester.
Sources
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