- InChI
- InChI=1S/C20H20F2O4/c1-2-3-6-11-25-19(23)16-7-4-5-8-17(16)20(24)26-13-14-12-15(21)9-10-18(14)22/h4-5,7-10,12H,2-3,6,11,13H2,1H3
- InChI Key
- NGHHIPDRCYRXQZ-UHFFFAOYSA-N
- Formula
- C20H20F2O4
- SMILES
-
CCCCCOC(=O)c1ccccc1C(=O)OCc1cc
(F)ccc1F - Molecular Weight1
- 362.37
- 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° | -544.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -899.30 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.33 | kJ/mol | Joback Calculated Property |
| log10WS | -6.40 | Crippen Calculated Property | |
| logPoct/wat | 4.669 | Crippen Calculated Property | |
| McVol | 263.560 | ml/mol | McGowan Calculated Property |
| Pc | 1575.95 | kPa | Joback Calculated Property |
| Inp | 2336.00 | NIST | |
| Tboil | 876.42 | K | Joback Calculated Property |
| Tc | 1090.09 | K | Joback Calculated Property |
| Tfus | 551.06 | K | Joback Calculated Property |
| Vc | 1.024 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [793.82; 855.05] | J/mol×K | [876.42; 1090.09] | 
|
| Cp,gas | 793.82 | J/mol×K | 876.42 | Joback Calculated Property |
| Cp,gas | 806.87 | J/mol×K | 912.03 | Joback Calculated Property |
| Cp,gas | 818.76 | J/mol×K | 947.64 | Joback Calculated Property |
| Cp,gas | 829.50 | J/mol×K | 983.25 | Joback Calculated Property |
| Cp,gas | 839.11 | J/mol×K | 1018.86 | Joback Calculated Property |
| Cp,gas | 847.62 | J/mol×K | 1054.47 | Joback Calculated Property |
| Cp,gas | 855.05 | J/mol×K | 1090.09 | Joback Calculated Property |
Similar Compounds
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Sources
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