- InChI
- InChI=1S/C18H20ClF5O4/c19-9-5-3-1-2-4-6-10-27-11(25)7-8-12(26)28-18-16(23)14(21)13(20)15(22)17(18)24/h1-10H2
- InChI Key
- JHXUKIHHLXCEOQ-UHFFFAOYSA-N
- Formula
- C18H20ClF5O4
- SMILES
-
O=C(CCC(=O)Oc1c(F)c(F)c(F)c(F)
c1F)OCCCCCCCCCl - Molecular Weight1
- 430.79
- 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 | 1.0282 | Relay (1.0) Calculated Property | |
| ΔfG° | -1288.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1566.92 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 59.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.96 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.52 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.36 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.190 | Crippen Calculated Property | |
| McVol | 276.690 | ml/mol | McGowan Calculated Property |
| Pc | 1222.55 | kPa | Joback Calculated Property |
| Inp | [2325.00; 2325.00] |
|
|
| Inp | 2325.00 | NIST | |
| Inp | 2325.00 | NIST | |
| Tboil | 597.58 | K | Relay (1.0) Calculated Property |
| Tc | 804.28 | K | Relay (1.0) Calculated Property |
| Tfus | 315.45 | K | Relay (1.0) Calculated Property |
| Vc | 1.029 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [821.50; 883.28] | J/mol×K | [849.18; 1040.95] |
|
| Cp,gas | 821.50 | J/mol×K | 849.18 | Joback Calculated Property |
| Cp,gas | 834.13 | J/mol×K | 881.14 | Joback Calculated Property |
| Cp,gas | 845.83 | J/mol×K | 913.10 | Joback Calculated Property |
| Cp,gas | 856.59 | J/mol×K | 945.06 | Joback Calculated Property |
| Cp,gas | 866.41 | J/mol×K | 977.03 | Joback Calculated Property |
| Cp,gas | 875.31 | J/mol×K | 1008.99 | Joback Calculated Property |
| Cp,gas | 883.28 | J/mol×K | 1040.95 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 8-chlorooctyl pentafluorophenyl ester.
Sources
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