- InChI
- InChI=1S/C16H6Cl3F5O4/c17-5-3-6(18)15(7(19)4-5)27-8(25)1-2-9(26)28-16-13(23)11(21)10(20)12(22)14(16)24/h3-4H,1-2H2
- InChI Key
- QZQFZGZNPZIYTM-UHFFFAOYSA-N
- Formula
- C16H6Cl3F5O4
- SMILES
-
O=C(CCC(=O)Oc1c(F)c(F)c(F)c(F)
c1F)Oc1c(Cl)cc(Cl)cc1Cl - Molecular Weight1
- 463.57
- 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° | -1246.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1509.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 88.44 | kJ/mol | Joback Calculated Property |
| log10WS | -7.46 | Crippen Calculated Property | |
| logPoct/wat | 5.634 | Crippen Calculated Property | |
| McVol | 249.230 | ml/mol | McGowan Calculated Property |
| Pc | 1657.84 | kPa | Joback Calculated Property |
| Inp | 2347.00 | NIST | |
| Tboil | 919.90 | K | Joback Calculated Property |
| Tc | 1137.17 | K | Joback Calculated Property |
| Tfus | 660.11 | K | Joback Calculated Property |
| Vc | 1.000 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [644.25; 671.76] | J/mol×K | [919.90; 1137.17] | 
|
| Cp,gas | 644.25 | J/mol×K | 919.90 | Joback Calculated Property |
| Cp,gas | 651.34 | J/mol×K | 956.11 | Joback Calculated Property |
| Cp,gas | 657.45 | J/mol×K | 992.32 | Joback Calculated Property |
| Cp,gas | 662.55 | J/mol×K | 1028.53 | Joback Calculated Property |
| Cp,gas | 666.65 | J/mol×K | 1064.75 | Joback Calculated Property |
| Cp,gas | 669.72 | J/mol×K | 1100.96 | Joback Calculated Property |
| Cp,gas | 671.76 | J/mol×K | 1137.17 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2,4,6-trichlorophenyl pentafluorophenyl ester.
Sources
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