- InChI
- InChI=1S/C25H38F2O4/c1-3-4-5-6-7-8-9-10-11-12-13-19-30-23(28)17-18-24(29)31-20(2)25-21(26)15-14-16-22(25)27/h14-16,20H,3-13,17-19H2,1-2H3
- InChI Key
- DZILCIHWYAGELE-UHFFFAOYSA-N
- Formula
- C25H38F2O4
- SMILES
-
CCCCCCCCCCCCCOC(=O)CCC(=O)OC(C
)c1c(F)cccc1F - Molecular Weight1
- 440.56
- 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).
- 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 | 1.1176 | Relay (1.0) Calculated Property | |
| ΔfG° | -607.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1302.23 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 61.98 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 120.59 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.10 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.10 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.203 | Crippen Calculated Property | |
| McVol | 357.770 | ml/mol | McGowan Calculated Property |
| Pc | 914.39 | kPa | Joback Calculated Property |
| Tboil | 650.02 | K | Relay (1.0) Calculated Property |
| Tc | 848.14 | K | Relay (1.0) Calculated Property |
| Tfus | 324.59 | K | Relay (1.0) Calculated Property |
| Vc | 1.343 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1194.93; 1274.88] | J/mol×K | [958.72; 1174.71] | 
|
| Cp,gas | 1194.93 | J/mol×K | 958.72 | Joback Calculated Property |
| Cp,gas | 1211.86 | J/mol×K | 994.72 | Joback Calculated Property |
| Cp,gas | 1227.29 | J/mol×K | 1030.72 | Joback Calculated Property |
| Cp,gas | 1241.27 | J/mol×K | 1066.72 | Joback Calculated Property |
| Cp,gas | 1253.84 | J/mol×K | 1102.72 | Joback Calculated Property |
| Cp,gas | 1265.03 | J/mol×K | 1138.72 | Joback Calculated Property |
| Cp,gas | 1274.88 | J/mol×K | 1174.71 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 1-(2,6-difluorophenyl)ethyl tridecyl ester.
Sources
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