- InChI
- InChI=1S/C14H15Cl3O4/c1-8(2)7-20-12(18)3-4-13(19)21-11-6-9(15)5-10(16)14(11)17/h5-6,8H,3-4,7H2,1-2H3
- InChI Key
- VSZGGQBPIKEDPE-UHFFFAOYSA-N
- Formula
- C14H15Cl3O4
- SMILES
-
CC(C)COC(=O)CCC(=O)Oc1cc(Cl)cc
(Cl)c1Cl - Molecular Weight1
- 353.62
- 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° | -355.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -672.27 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.10 | kJ/mol | Joback Calculated Property |
| log10WS | -4.97 | Crippen Calculated Property | |
| logPoct/wat | 4.532 | Crippen Calculated Property | |
| McVol | 235.960 | ml/mol | McGowan Calculated Property |
| Pc | 1911.91 | kPa | Joback Calculated Property |
| Inp | 2257.00 | NIST | |
| Tboil | 825.77 | K | Joback Calculated Property |
| Tc | 1046.49 | K | Joback Calculated Property |
| Tfus | 530.60 | K | Joback Calculated Property |
| Vc | 0.900 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [610.41; 662.39] | J/mol×K | [825.77; 1046.49] | 
|
| Cp,gas | 610.41 | J/mol×K | 825.77 | Joback Calculated Property |
| Cp,gas | 621.51 | J/mol×K | 862.56 | Joback Calculated Property |
| Cp,gas | 631.62 | J/mol×K | 899.34 | Joback Calculated Property |
| Cp,gas | 640.77 | J/mol×K | 936.13 | Joback Calculated Property |
| Cp,gas | 648.94 | J/mol×K | 972.92 | Joback Calculated Property |
| Cp,gas | 656.15 | J/mol×K | 1009.70 | Joback Calculated Property |
| Cp,gas | 662.39 | J/mol×K | 1046.49 | Joback Calculated Property |
| η | [0.0000775; 0.0005101] | Pa×s | [530.60; 825.77] |
|
| η | 0.0005101 | Pa×s | 530.60 | Joback Calculated Property |
| η | 0.0003261 | Pa×s | 579.80 | Joback Calculated Property |
| η | 0.0002236 | Pa×s | 628.99 | Joback Calculated Property |
| η | 0.0001620 | Pa×s | 678.18 | Joback Calculated Property |
| η | 0.0001226 | Pa×s | 727.38 | Joback Calculated Property |
| η | 0.0000961 | Pa×s | 776.58 | Joback Calculated Property |
| η | 0.0000775 | Pa×s | 825.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, isobutyl 2,3,5-trichlorophenyl ester.
Sources
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