- InChI
- InChI=1S/C19H12F2O2/c20-15-8-11-17(18(21)12-15)19(22)23-16-9-6-14(7-10-16)13-4-2-1-3-5-13/h1-12H
- InChI Key
- YMIADCHHVQVMNO-UHFFFAOYSA-N
- Formula
- C19H12F2O2
- SMILES
-
O=C(Oc1ccc(-c2ccccc2)cc1)c1ccc
(F)cc1F - Molecular Weight1
- 310.29
- 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° | -206.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -397.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.22 | kJ/mol | Joback Calculated Property |
| log10WS | -6.82 | Crippen Calculated Property | |
| logPoct/wat | 4.851 | Crippen Calculated Property | |
| McVol | 218.270 | ml/mol | McGowan Calculated Property |
| Pc | 2187.68 | kPa | Joback Calculated Property |
| Inp | 2465.00 | NIST | |
| Tboil | 803.93 | K | Joback Calculated Property |
| Tc | 1047.01 | K | Joback Calculated Property |
| Tfus | 494.05 | K | Joback Calculated Property |
| Vc | 0.836 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [602.57; 665.60] | J/mol×K | [803.93; 1047.01] | 
|
| Cp,gas | 602.57 | J/mol×K | 803.93 | Joback Calculated Property |
| Cp,gas | 616.06 | J/mol×K | 844.44 | Joback Calculated Property |
| Cp,gas | 628.26 | J/mol×K | 884.96 | Joback Calculated Property |
| Cp,gas | 639.25 | J/mol×K | 925.47 | Joback Calculated Property |
| Cp,gas | 649.10 | J/mol×K | 965.98 | Joback Calculated Property |
| Cp,gas | 657.85 | J/mol×K | 1006.50 | Joback Calculated Property |
| Cp,gas | 665.60 | J/mol×K | 1047.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,4-Difluorobenzoic acid, 4-biphenyl ester.
Sources
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