- InChI
- InChI=1S/C17H17F7O4/c1-10(2)11-3-5-12(6-4-11)28-14(26)8-7-13(25)27-9-15(18,19)16(20,21)17(22,23)24/h3-6,10H,7-9H2,1-2H3
- InChI Key
- CSYKNNSZXLQVBV-UHFFFAOYSA-N
- Formula
- C17H17F7O4
- SMILES
-
CC(C)c1ccc(OC(=O)CCC(=O)OCC(F)
(F)C(F)(F)C(F)(F)F)cc1 - Molecular Weight1
- 418.30
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8212 | Relay (... Calculated Property | |
| ΔfG° | -1630.39 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -2217.22 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 34.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.09 | kJ/mol | Relay (... Calculated Property |
| IE | 8.80 | eV | Relay (... Calculated Property |
| log10WS | -6.18 | Relay (... Calculated Property | |
| logPoct/wat | 4.872 | Crippen Calculated Property | |
| McVol | 253.900 | ml/mol | McGowan Calculated Property |
| Pc | 1379.91 | kPa | Joback Calculated Property |
| Inp | 1843.00 | NIST | |
| Tboil | 573.06 | K | Relay (... Calculated Property |
| Tc | 729.65 | K | Relay (... Calculated Property |
| Tfus | 295.71 | K | Relay (... Calculated Property |
| Vc | 0.932 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [764.57; 829.24] | J/mol×K | [757.36; 941.79] | 
|
| Cp,gas | 764.57 | J/mol×K | 757.36 | Joback Calculated Property |
| Cp,gas | 777.46 | J/mol×K | 788.10 | Joback Calculated Property |
| Cp,gas | 789.43 | J/mol×K | 818.84 | Joback Calculated Property |
| Cp,gas | 800.54 | J/mol×K | 849.57 | Joback Calculated Property |
| Cp,gas | 810.84 | J/mol×K | 880.31 | Joback Calculated Property |
| Cp,gas | 820.39 | J/mol×K | 911.05 | Joback Calculated Property |
| Cp,gas | 829.24 | J/mol×K | 941.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2,2,3,3,4,4,4-heptafluorobutyl 4-isopropylphenyl ester.
Sources
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