- InChI
- InChI=1S/C14H14ClFO4/c1-2-3-9-19-12(17)7-8-13(18)20-14-10(15)5-4-6-11(14)16/h2,4-6H,1,3,7-9H2
- InChI Key
- RIMCCNJHGYRISV-UHFFFAOYSA-N
- Formula
- C14H14ClFO4
- SMILES
-
C=CCCOC(=O)CCC(=O)Oc1c(F)cccc1
Cl - Molecular Weight1
- 300.71
- 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° | -426.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -694.72 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.85 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.57 | kJ/mol | Joback Calculated Property |
| log10WS | -4.03 | Crippen Calculated Property | |
| logPoct/wat | 3.284 | Crippen Calculated Property | |
| McVol | 208.950 | ml/mol | McGowan Calculated Property |
| Pc | 2049.31 | kPa | Joback Calculated Property |
| Inp | [1967.00; 1967.00] |
|
|
| Inp | 1967.00 | NIST | |
| Inp | 1967.00 | NIST | |
| Tboil | 742.32 | K | Joback Calculated Property |
| Tc | 948.11 | K | Joback Calculated Property |
| Tfus | 472.07 | K | Joback Calculated Property |
| Vc | 0.807 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [547.99; 608.22] | J/mol×K | [742.32; 948.11] |
|
| Cp,gas | 547.99 | J/mol×K | 742.32 | Joback Calculated Property |
| Cp,gas | 560.08 | J/mol×K | 776.62 | Joback Calculated Property |
| Cp,gas | 571.33 | J/mol×K | 810.92 | Joback Calculated Property |
| Cp,gas | 581.76 | J/mol×K | 845.21 | Joback Calculated Property |
| Cp,gas | 591.38 | J/mol×K | 879.51 | Joback Calculated Property |
| Cp,gas | 600.20 | J/mol×K | 913.81 | Joback Calculated Property |
| Cp,gas | 608.22 | J/mol×K | 948.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2-chloro-6-fluorophenyl but-3-en-1-yl ester.
Sources
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