- InChI
- InChI=1S/C12H19Cl3O4/c1-4-9(8(2)3)19-11(17)6-5-10(16)18-7-12(13,14)15/h8-9H,4-7H2,1-3H3
- InChI Key
- BUBXDLJRIRMJOQ-UHFFFAOYSA-N
- Formula
- C12H19Cl3O4
- SMILES
-
CCC(OC(=O)CCC(=O)OCC(Cl)(Cl)Cl
)C(C)C - Molecular Weight1
- 333.64
- 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° | -455.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -847.14 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 30.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.70 | kJ/mol | Joback Calculated Property |
| log10WS | -4.00 | Crippen Calculated Property | |
| logPoct/wat | 3.658 | Crippen Calculated Property | |
| McVol | 231.540 | ml/mol | McGowan Calculated Property |
| Pc | 1804.63 | kPa | Joback Calculated Property |
| Inp | [1835.00; 1835.00] |
|
|
| Inp | 1835.00 | NIST | |
| Inp | 1835.00 | NIST | |
| Tboil | 734.72 | K | Joback Calculated Property |
| Tc | 938.40 | K | Joback Calculated Property |
| Tfus | 431.50 | K | Joback Calculated Property |
| Vc | 0.879 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [602.66; 666.89] | J/mol×K | [734.72; 938.40] |
|
| Cp,gas | 602.66 | J/mol×K | 734.72 | Joback Calculated Property |
| Cp,gas | 615.44 | J/mol×K | 768.67 | Joback Calculated Property |
| Cp,gas | 627.36 | J/mol×K | 802.61 | Joback Calculated Property |
| Cp,gas | 638.44 | J/mol×K | 836.56 | Joback Calculated Property |
| Cp,gas | 648.71 | J/mol×K | 870.51 | Joback Calculated Property |
| Cp,gas | 658.18 | J/mol×K | 904.45 | Joback Calculated Property |
| Cp,gas | 666.89 | J/mol×K | 938.40 | Joback Calculated Property |
| η | [0.0000760; 0.0013481] | Pa×s | [431.50; 734.72] |
|
| η | 0.0013481 | Pa×s | 431.50 | Joback Calculated Property |
| η | 0.0006492 | Pa×s | 482.04 | Joback Calculated Property |
| η | 0.0003592 | Pa×s | 532.57 | Joback Calculated Property |
| η | 0.0002202 | Pa×s | 583.11 | Joback Calculated Property |
| η | 0.0001459 | Pa×s | 633.65 | Joback Calculated Property |
| η | 0.0001028 | Pa×s | 684.18 | Joback Calculated Property |
| η | 0.0000760 | Pa×s | 734.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 2-methylpent-3-yl 2,2,2-trichloroethyl ester.
Sources
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