- InChI
- InChI=1S/C16H19Cl3O4/c1-9(16(2,3)4)22-13(20)5-6-14(21)23-15-11(18)7-10(17)8-12(15)19/h7-9H,5-6H2,1-4H3
- InChI Key
- RFNWXBMGIQPPMV-UHFFFAOYSA-N
- Formula
- C16H19Cl3O4
- SMILES
-
CC(OC(=O)CCC(=O)Oc1c(Cl)cc(Cl)
cc1Cl)C(C)(C)C - Molecular Weight1
- 381.68
- 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° | -335.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -722.30 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.25 | kJ/mol | Joback Calculated Property |
| log10WS | -5.92 | Crippen Calculated Property | |
| logPoct/wat | 5.310 | Crippen Calculated Property | |
| McVol | 264.140 | ml/mol | McGowan Calculated Property |
| Pc | 1652.46 | kPa | Joback Calculated Property |
| Inp | [2342.00; 2342.00] |
|
|
| Inp | 2342.00 | NIST | |
| Inp | 2342.00 | NIST | |
| Tboil | 868.30 | K | Joback Calculated Property |
| Tc | 1093.36 | K | Joback Calculated Property |
| Tfus | 555.56 | K | Joback Calculated Property |
| Vc | 1.002 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [722.20; 777.61] | J/mol×K | [868.30; 1093.36] |
|
| Cp,gas | 722.20 | J/mol×K | 868.30 | Joback Calculated Property |
| Cp,gas | 734.00 | J/mol×K | 905.81 | Joback Calculated Property |
| Cp,gas | 744.73 | J/mol×K | 943.32 | Joback Calculated Property |
| Cp,gas | 754.43 | J/mol×K | 980.83 | Joback Calculated Property |
| Cp,gas | 763.12 | J/mol×K | 1018.34 | Joback Calculated Property |
| Cp,gas | 770.84 | J/mol×K | 1055.85 | Joback Calculated Property |
| Cp,gas | 777.61 | J/mol×K | 1093.36 | Joback Calculated Property |
| η | [0.0000457; 0.0003702] | Pa×s | [555.56; 868.30] |
|
| η | 0.0003702 | Pa×s | 555.56 | Joback Calculated Property |
| η | 0.0002250 | Pa×s | 607.68 | Joback Calculated Property |
| η | 0.0001479 | Pa×s | 659.81 | Joback Calculated Property |
| η | 0.0001034 | Pa×s | 711.93 | Joback Calculated Property |
| η | 0.0000759 | Pa×s | 764.05 | Joback Calculated Property |
| η | 0.0000580 | Pa×s | 816.18 | Joback Calculated Property |
| η | 0.0000457 | Pa×s | 868.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2,4,6-trichlorophenyl 3,3-dimethylbut-2-yl ester.
Sources
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