- InChI
- InChI=1S/C16H11F3O4/c17-10-2-1-3-13(7-10)22-15(20)4-5-16(21)23-14-8-11(18)6-12(19)9-14/h1-3,6-9H,4-5H2
- InChI Key
- WWXAXERVYPFYIC-UHFFFAOYSA-N
- Formula
- C16H11F3O4
- SMILES
-
O=C(CCC(=O)Oc1cc(F)cc(F)c1)Oc1
cccc(F)c1 - Molecular Weight1
- 324.25
- 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° | -772.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1012.85 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.61 | kJ/mol | Joback Calculated Property |
| log10WS | -4.74 | Crippen Calculated Property | |
| logPoct/wat | 3.395 | Crippen Calculated Property | |
| McVol | 208.970 | ml/mol | McGowan Calculated Property |
| Pc | 2104.20 | kPa | Joback Calculated Property |
| Inp | 2125.00 | NIST | |
| Tboil | 784.17 | K | Joback Calculated Property |
| Tc | 996.52 | K | Joback Calculated Property |
| Tfus | 506.57 | K | Joback Calculated Property |
| Vc | 0.818 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [578.83; 634.23] | J/mol×K | [784.17; 996.52] | 
|
| Cp,gas | 578.83 | J/mol×K | 784.17 | Joback Calculated Property |
| Cp,gas | 590.46 | J/mol×K | 819.56 | Joback Calculated Property |
| Cp,gas | 601.11 | J/mol×K | 854.95 | Joback Calculated Property |
| Cp,gas | 610.80 | J/mol×K | 890.34 | Joback Calculated Property |
| Cp,gas | 619.54 | J/mol×K | 925.73 | Joback Calculated Property |
| Cp,gas | 627.35 | J/mol×K | 961.12 | Joback Calculated Property |
| Cp,gas | 634.23 | J/mol×K | 996.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 3,5-difluorophenyl 3-fluorophenyl ester.
Sources
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