- InChI
- InChI=1S/C16H18F4O4/c17-15(18)16(19,20)11-24-14(22)8-4-7-13(21)23-10-9-12-5-2-1-3-6-12/h1-3,5-6,15H,4,7-11H2
- InChI Key
- IVLGMOSBMZPFFR-UHFFFAOYSA-N
- Formula
- C16H18F4O4
- SMILES
-
O=C(CCCC(=O)OCC(F)(F)C(F)F)OCC
c1ccccc1 - Molecular Weight1
- 350.31
- 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° | -1050.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1425.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.85 | kJ/mol | Joback Calculated Property |
| log10WS | -3.98 | Crippen Calculated Property | |
| logPoct/wat | 3.386 | Crippen Calculated Property | |
| McVol | 234.500 | ml/mol | McGowan Calculated Property |
| Pc | 1620.68 | kPa | Joback Calculated Property |
| Inp | [1906.00; 1906.00] |
|
|
| Inp | 1906.00 | NIST | |
| Inp | 1906.00 | NIST | |
| Tboil | 738.15 | K | Joback Calculated Property |
| Tc | 924.86 | K | Joback Calculated Property |
| Tfus | 430.60 | K | Joback Calculated Property |
| Vc | 0.926 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [683.00; 751.83] | J/mol×K | [738.15; 924.86] |
|
| Cp,gas | 683.00 | J/mol×K | 738.15 | Joback Calculated Property |
| Cp,gas | 696.62 | J/mol×K | 769.27 | Joback Calculated Property |
| Cp,gas | 709.34 | J/mol×K | 800.39 | Joback Calculated Property |
| Cp,gas | 721.19 | J/mol×K | 831.51 | Joback Calculated Property |
| Cp,gas | 732.20 | J/mol×K | 862.62 | Joback Calculated Property |
| Cp,gas | 742.41 | J/mol×K | 893.74 | Joback Calculated Property |
| Cp,gas | 751.83 | J/mol×K | 924.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,2,3,3-tetrafluoropropyl phenethyl ester.
Sources
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