- InChI
- InChI=1S/C16H19ClO4/c1-4-5-12(3)20-15(18)8-9-16(19)21-13-6-7-14(17)11(2)10-13/h4,6-7,10,12H,1,5,8-9H2,2-3H3
- InChI Key
- KGHVXEJBUKAHJP-UHFFFAOYSA-N
- Formula
- C16H19ClO4
- SMILES
-
C=CCC(C)OC(=O)CCC(=O)Oc1ccc(Cl
)c(C)c1 - Molecular Weight1
- 310.77
- 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).
- 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° | -217.38 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -545.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.45 | kJ/mol | Joback Calculated Property |
| log10WS | -4.70 | Crippen Calculated Property | |
| logPoct/wat | 3.842 | Crippen Calculated Property | |
| McVol | 235.360 | ml/mol | McGowan Calculated Property |
| Pc | 1813.86 | kPa | Joback Calculated Property |
| Inp | [2168.00; 2168.00] |
|
|
| Inp | 2168.00 | NIST | |
| Inp | 2168.00 | NIST | |
| Tboil | 788.37 | K | Joback Calculated Property |
| Tc | 1000.33 | K | Joback Calculated Property |
| Tfus | 479.02 | K | Joback Calculated Property |
| Vc | 0.895 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [648.86; 715.59] | J/mol×K | [788.37; 1000.33] |
|
| Cp,gas | 648.86 | J/mol×K | 788.37 | Joback Calculated Property |
| Cp,gas | 662.43 | J/mol×K | 823.70 | Joback Calculated Property |
| Cp,gas | 675.00 | J/mol×K | 859.02 | Joback Calculated Property |
| Cp,gas | 686.59 | J/mol×K | 894.35 | Joback Calculated Property |
| Cp,gas | 697.20 | J/mol×K | 929.68 | Joback Calculated Property |
| Cp,gas | 706.87 | J/mol×K | 965.00 | Joback Calculated Property |
| Cp,gas | 715.59 | J/mol×K | 1000.33 | Joback Calculated Property |
| η | [0.0000816; 0.0007025] | Pa×s | [479.02; 788.37] |
|
| η | 0.0007025 | Pa×s | 479.02 | Joback Calculated Property |
| η | 0.0004122 | Pa×s | 530.58 | Joback Calculated Property |
| η | 0.0002658 | Pa×s | 582.14 | Joback Calculated Property |
| η | 0.0001841 | Pa×s | 633.69 | Joback Calculated Property |
| η | 0.0001347 | Pa×s | 685.25 | Joback Calculated Property |
| η | 0.0001030 | Pa×s | 736.81 | Joback Calculated Property |
| η | 0.0000816 | Pa×s | 788.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 4-chloro-3-methylphenyl pent-4-en-2-yl ester.
Sources
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