- InChI
- InChI=1S/C22H31ClO4/c1-2-3-4-5-6-7-8-9-10-11-17-26-21(24)15-16-22(25)27-20-14-12-13-19(23)18-20/h10-14,18H,2-9,15-17H2,1H3/b11-10+
- InChI Key
- SPGFJKZEHMWBTJ-ZHACJKMWSA-N
- Formula
- C22H31ClO4
- SMILES
-
CCCCCCCCCC=CCOC(=O)CCC(=O)Oc1c
ccc(Cl)c1 - Molecular Weight1
- 394.93
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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 | 0.9937 | Relay (... Calculated Property | |
| ΔfG° | -162.41 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -833.86 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 56.36 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 115.63 | kJ/mol | Relay (... Calculated Property |
| IE | 8.65 | eV | Relay (... Calculated Property |
| log10WS | -6.85 | Relay (... Calculated Property | |
| logPoct/wat | 6.266 | Crippen Calculated Property | |
| McVol | 319.900 | ml/mol | McGowan Calculated Property |
| Pc | 1183.34 | kPa | Joback Calculated Property |
| Inp | [2896.00; 2896.00] |
|
|
| Inp | 2896.00 | NIST | |
| Inp | 2896.00 | NIST | |
| Tboil | 659.75 | K | Relay (... Calculated Property |
| Tc | 868.49 | K | Relay (... Calculated Property |
| Tfus | 294.03 | K | Relay (... Calculated Property |
| Vc | 1.157 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [996.34; 1070.12] | J/mol×K | [928.59; 1140.81] |
|
| Cp,gas | 996.34 | J/mol×K | 928.59 | Joback Calculated Property |
| Cp,gas | 1011.37 | J/mol×K | 963.96 | Joback Calculated Property |
| Cp,gas | 1025.24 | J/mol×K | 999.33 | Joback Calculated Property |
| Cp,gas | 1038.00 | J/mol×K | 1034.70 | Joback Calculated Property |
| Cp,gas | 1049.70 | J/mol×K | 1070.07 | Joback Calculated Property |
| Cp,gas | 1060.39 | J/mol×K | 1105.44 | Joback Calculated Property |
| Cp,gas | 1070.12 | J/mol×K | 1140.81 | Joback Calculated Property |
| η | [0.0000308; 0.0003584] | Pa×s | [545.80; 928.59] |
|
| η | 0.0003584 | Pa×s | 545.80 | Joback Calculated Property |
| η | 0.0001922 | Pa×s | 609.60 | Joback Calculated Property |
| η | 0.0001160 | Pa×s | 673.40 | Joback Calculated Property |
| η | 0.0000764 | Pa×s | 737.19 | Joback Calculated Property |
| η | 0.0000538 | Pa×s | 800.99 | Joback Calculated Property |
| η | 0.0000399 | Pa×s | 864.79 | Joback Calculated Property |
| η | 0.0000308 | Pa×s | 928.59 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, dodec-2-en-1-yl 3-chlorophenyl ester.
Sources
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