- InChI
- InChI=1S/C16H19F3O4/c1-2-11-22-13(20)9-6-10-14(21)23-15(16(17,18)19)12-7-4-3-5-8-12/h3-5,7-8,15H,2,6,9-11H2,1H3
- InChI Key
- GOOZRCSTYXLYLH-UHFFFAOYSA-N
- Formula
- C16H19F3O4
- SMILES
-
CCCOC(=O)CCCC(=O)OC(c1ccccc1)C
(F)(F)F - Molecular Weight1
- 332.31
- 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° | -855.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1229.00 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.66 | kJ/mol | Joback Calculated Property |
| log10WS | -4.47 | Crippen Calculated Property | |
| logPoct/wat | 3.957 | Crippen Calculated Property | |
| McVol | 232.730 | ml/mol | McGowan Calculated Property |
| Pc | 1681.03 | kPa | Joback Calculated Property |
| Inp | 1874.00 | NIST | |
| Tboil | 738.88 | K | Joback Calculated Property |
| Tc | 931.14 | K | Joback Calculated Property |
| Tfus | 430.01 | K | Joback Calculated Property |
| Vc | 0.908 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [675.23; 746.28] | J/mol×K | [738.88; 931.14] | 
|
| Cp,gas | 675.23 | J/mol×K | 738.88 | Joback Calculated Property |
| Cp,gas | 689.33 | J/mol×K | 770.92 | Joback Calculated Property |
| Cp,gas | 702.48 | J/mol×K | 802.97 | Joback Calculated Property |
| Cp,gas | 714.72 | J/mol×K | 835.01 | Joback Calculated Property |
| Cp,gas | 726.08 | J/mol×K | 867.06 | Joback Calculated Property |
| Cp,gas | 736.59 | J/mol×K | 899.10 | Joback Calculated Property |
| Cp,gas | 746.28 | J/mol×K | 931.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 1-phenyl-2,2,2-trifluoroethyl propyl ester.
Sources
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