- InChI
- InChI=1S/C13F10O2/c14-2-1(3(15)5(17)6(18)4(2)16)13(24)25-12-10(22)8(20)7(19)9(21)11(12)23
- InChI Key
- ZTQHONLMYPIEDI-UHFFFAOYSA-N
- Formula
- C13F10O2
- SMILES
-
O=C(Oc1c(F)c(F)c(F)c(F)c1F)c1c
(F)c(F)c(F)c(F)c1F - Molecular Weight1
- 378.12
- 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° | -1994.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2159.19 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.69 | kJ/mol | Joback Calculated Property |
| log10WS | -6.87 | Crippen Calculated Property | |
| logPoct/wat | 4.297 | Crippen Calculated Property | |
| McVol | 171.650 | ml/mol | McGowan Calculated Property |
| Pc | 1798.51 | kPa | Joback Calculated Property |
| Inp | 1342.00 | NIST | |
| Tboil | 668.99 | K | Joback Calculated Property |
| Tc | 840.70 | K | Joback Calculated Property |
| Tfus | 492.37 | K | Joback Calculated Property |
| Vc | 0.751 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [435.32; 476.56] | J/mol×K | [668.99; 840.70] | 
|
| Cp,gas | 435.32 | J/mol×K | 668.99 | Joback Calculated Property |
| Cp,gas | 443.20 | J/mol×K | 697.61 | Joback Calculated Property |
| Cp,gas | 450.70 | J/mol×K | 726.23 | Joback Calculated Property |
| Cp,gas | 457.79 | J/mol×K | 754.85 | Joback Calculated Property |
| Cp,gas | 464.47 | J/mol×K | 783.46 | Joback Calculated Property |
| Cp,gas | 470.73 | J/mol×K | 812.08 | Joback Calculated Property |
| Cp,gas | 476.56 | J/mol×K | 840.70 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Pentafluorobenzoic acid, pentafluorophenyl ester.
Sources
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