- InChI
- InChI=1S/C15H17FO4/c1-2-3-11-19-14(17)9-6-10-15(18)20-13-8-5-4-7-12(13)16/h2,4-5,7-8H,1,3,6,9-11H2
- InChI Key
- UZLGYUHAEMVVGG-UHFFFAOYSA-N
- Formula
- C15H17FO4
- SMILES
- C=CCCOC(=O)CCCC(=O)Oc1ccccc1F
- Molecular Weight1
- 280.29
- 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° | -396.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -688.15 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.75 | kJ/mol | Joback Calculated Property |
| log10WS | -3.76 | Crippen Calculated Property | |
| logPoct/wat | 3.021 | Crippen Calculated Property | |
| McVol | 210.800 | ml/mol | McGowan Calculated Property |
| Pc | 1970.05 | kPa | Joback Calculated Property |
| Inp | [1956.00; 1956.00] |
|
|
| Inp | 1956.00 | NIST | |
| Inp | 1956.00 | NIST | |
| Tboil | 722.79 | K | Joback Calculated Property |
| Tc | 922.17 | K | Joback Calculated Property |
| Tfus | 440.90 | K | Joback Calculated Property |
| Vc | 0.815 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [577.11; 646.21] | J/mol×K | [722.79; 922.17] |
|
| Cp,gas | 577.11 | J/mol×K | 722.79 | Joback Calculated Property |
| Cp,gas | 590.75 | J/mol×K | 756.02 | Joback Calculated Property |
| Cp,gas | 603.52 | J/mol×K | 789.25 | Joback Calculated Property |
| Cp,gas | 615.44 | J/mol×K | 822.48 | Joback Calculated Property |
| Cp,gas | 626.52 | J/mol×K | 855.71 | Joback Calculated Property |
| Cp,gas | 636.77 | J/mol×K | 888.94 | Joback Calculated Property |
| Cp,gas | 646.21 | J/mol×K | 922.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2-fluorophenyl but-3-en-1-yl ester.
Sources
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