- InChI
- InChI=1S/C18H22F4O4/c1-2-3-4-11-25-16(23)9-6-10-17(24)26-12-13-14(18(20,21)22)7-5-8-15(13)19/h5,7-8H,2-4,6,9-12H2,1H3
- InChI Key
- FLTYBWGNLBQLHD-UHFFFAOYSA-N
- Formula
- C18H22F4O4
- SMILES
-
CCCCCOC(=O)CCCC(=O)OCc1c(F)ccc
c1C(F)(F)F - Molecular Weight1
- 378.36
- 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° | -1050.41 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1484.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.12 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.01 | kJ/mol | Joback Calculated Property |
| log10WS | -5.70 | Crippen Calculated Property | |
| logPoct/wat | 4.791 | Crippen Calculated Property | |
| McVol | 262.680 | ml/mol | McGowan Calculated Property |
| Pc | 1357.63 | kPa | Joback Calculated Property |
| Inp | 2316.00 | NIST | |
| Tboil | 794.31 | K | Joback Calculated Property |
| Tc | 981.98 | K | Joback Calculated Property |
| Tfus | 493.18 | K | Joback Calculated Property |
| Vc | 1.044 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [792.30; 862.95] | J/mol×K | [794.31; 981.98] | 
|
| Cp,gas | 792.30 | J/mol×K | 794.31 | Joback Calculated Property |
| Cp,gas | 806.29 | J/mol×K | 825.59 | Joback Calculated Property |
| Cp,gas | 819.36 | J/mol×K | 856.87 | Joback Calculated Property |
| Cp,gas | 831.53 | J/mol×K | 888.15 | Joback Calculated Property |
| Cp,gas | 842.83 | J/mol×K | 919.42 | Joback Calculated Property |
| Cp,gas | 853.30 | J/mol×K | 950.70 | Joback Calculated Property |
| Cp,gas | 862.95 | J/mol×K | 981.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2-fluoro-6-(trifluoromethyl)benzyl pentyl ester.
Sources
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