- InChI
- InChI=1S/C17H23FO4/c1-12(2)11-21-16(19)9-6-10-17(20)22-13(3)14-7-4-5-8-15(14)18/h4-5,7-8,12-13H,6,9-11H2,1-3H3
- InChI Key
- SJPABTCTLDLPHX-UHFFFAOYSA-N
- Formula
- C17H23FO4
- SMILES
-
CC(C)COC(=O)CCCC(=O)OC(C)c1ccc
cc1F - Molecular Weight1
- 310.36
- 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° | -472.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -865.42 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.09 | kJ/mol | Joback Calculated Property |
| log10WS | -4.32 | Crippen Calculated Property | |
| logPoct/wat | 3.799 | Crippen Calculated Property | |
| McVol | 243.280 | ml/mol | McGowan Calculated Property |
| Pc | 1637.78 | kPa | Joback Calculated Property |
| Inp | 2046.00 | NIST | |
| Tboil | 770.99 | K | Joback Calculated Property |
| Tc | 970.54 | K | Joback Calculated Property |
| Tfus | 435.20 | K | Joback Calculated Property |
| Vc | 0.933 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [713.08; 789.66] | J/mol×K | [770.99; 970.54] | 
|
| Cp,gas | 713.08 | J/mol×K | 770.99 | Joback Calculated Property |
| Cp,gas | 728.35 | J/mol×K | 804.25 | Joback Calculated Property |
| Cp,gas | 742.60 | J/mol×K | 837.51 | Joback Calculated Property |
| Cp,gas | 755.84 | J/mol×K | 870.76 | Joback Calculated Property |
| Cp,gas | 768.09 | J/mol×K | 904.02 | Joback Calculated Property |
| Cp,gas | 779.35 | J/mol×K | 937.28 | Joback Calculated Property |
| Cp,gas | 789.66 | J/mol×K | 970.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 1-(2-fluorophenyl)ethyl isobutyl ester.
Sources
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