- InChI
- InChI=1S/C15H15F3O5/c1-10(15(16,17)18)22-13(20)7-4-8-14(21)23-12-6-3-2-5-11(12)9-19/h2-3,5-6,9-10H,4,7-8H2,1H3
- InChI Key
- ZOJSRBZDCBRVTP-UHFFFAOYSA-N
- Formula
- C15H15F3O5
- SMILES
-
CC(OC(=O)CCCC(=O)Oc1ccccc1C=O)
C(F)(F)F - Molecular Weight1
- 332.27
- 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° | -973.19 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1305.41 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.82 | kJ/mol | Joback Calculated Property |
| log10WS | -4.18 | Crippen Calculated Property | |
| logPoct/wat | 3.069 | Crippen Calculated Property | |
| McVol | 220.210 | ml/mol | McGowan Calculated Property |
| Pc | 1916.94 | kPa | Joback Calculated Property |
| Inp | 1941.00 | NIST | |
| Tboil | 769.64 | K | Joback Calculated Property |
| Tc | 967.65 | K | Joback Calculated Property |
| Tfus | 473.26 | K | Joback Calculated Property |
| Vc | 0.870 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [635.20; 693.83] | J/mol×K | [769.64; 967.65] | 
|
| Cp,gas | 635.20 | J/mol×K | 769.64 | Joback Calculated Property |
| Cp,gas | 647.11 | J/mol×K | 802.64 | Joback Calculated Property |
| Cp,gas | 658.13 | J/mol×K | 835.64 | Joback Calculated Property |
| Cp,gas | 668.29 | J/mol×K | 868.64 | Joback Calculated Property |
| Cp,gas | 677.60 | J/mol×K | 901.64 | Joback Calculated Property |
| Cp,gas | 686.11 | J/mol×K | 934.65 | Joback Calculated Property |
| Cp,gas | 693.83 | J/mol×K | 967.65 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 1,1,1-trifluoroprop-2-yl 2-formylphenyl ester.
Sources
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