- InChI
- InChI=1S/C12H20Cl2O4/c1-9(2)7-17-11(15)5-3-4-6-12(16)18-8-10(13)14/h9-10H,3-8H2,1-2H3
- InChI Key
- CPCFIRJBGFNZLS-UHFFFAOYSA-N
- Formula
- C12H20Cl2O4
- SMILES
- CC(C)COC(=O)CCCCC(=O)OCC(Cl)Cl
- Molecular Weight1
- 299.19
- 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° | -446.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -822.65 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.61 | kJ/mol | Joback Calculated Property |
| log10WS | -3.24 | Crippen Calculated Property | |
| logPoct/wat | 3.093 | Crippen Calculated Property | |
| McVol | 219.300 | ml/mol | McGowan Calculated Property |
| Pc | 1832.54 | kPa | Joback Calculated Property |
| Inp | [1852.00; 1852.00] |
|
|
| Inp | 1852.00 | NIST | |
| Inp | 1852.00 | NIST | |
| Tboil | 700.52 | K | Joback Calculated Property |
| Tc | 892.04 | K | Joback Calculated Property |
| Tfus | 399.16 | K | Joback Calculated Property |
| Vc | 0.842 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [574.07; 643.60] | J/mol×K | [700.52; 892.04] |
|
| Cp,gas | 574.07 | J/mol×K | 700.52 | Joback Calculated Property |
| Cp,gas | 587.54 | J/mol×K | 732.44 | Joback Calculated Property |
| Cp,gas | 600.25 | J/mol×K | 764.36 | Joback Calculated Property |
| Cp,gas | 612.20 | J/mol×K | 796.28 | Joback Calculated Property |
| Cp,gas | 623.41 | J/mol×K | 828.20 | Joback Calculated Property |
| Cp,gas | 633.88 | J/mol×K | 860.12 | Joback Calculated Property |
| Cp,gas | 643.60 | J/mol×K | 892.04 | Joback Calculated Property |
| η | [0.0001058; 0.0017341] | Pa×s | [399.16; 700.52] |
|
| η | 0.0017341 | Pa×s | 399.16 | Joback Calculated Property |
| η | 0.0008385 | Pa×s | 449.39 | Joback Calculated Property |
| η | 0.0004692 | Pa×s | 499.61 | Joback Calculated Property |
| η | 0.0002919 | Pa×s | 549.84 | Joback Calculated Property |
| η | 0.0001967 | Pa×s | 600.07 | Joback Calculated Property |
| η | 0.0001408 | Pa×s | 650.29 | Joback Calculated Property |
| η | 0.0001058 | Pa×s | 700.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, 2,2-dichloroethyl isobutyl ester.
Sources
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