- InChI
- InChI=1S/C13H23ClO3/c1-6-13(7-2,11(14)15)12(16)17-10(5)8-9(3)4/h9-10H,6-8H2,1-5H3
- InChI Key
- HTDWBWLHGHSFCP-UHFFFAOYSA-N
- Formula
- C13H23ClO3
- SMILES
-
CCC(CC)(C(=O)Cl)C(=O)OC(C)CC(C
)C - Molecular Weight1
- 262.77
- 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° | -318.23 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -704.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 23.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.75 | kJ/mol | Joback Calculated Property |
| log10WS | -3.68 | Crippen Calculated Property | |
| logPoct/wat | 3.536 | Crippen Calculated Property | |
| McVol | 215.280 | ml/mol | McGowan Calculated Property |
| Pc | 1796.98 | kPa | Joback Calculated Property |
| Inp | 1406.00 | NIST | |
| Tboil | 660.32 | K | Joback Calculated Property |
| Tc | 855.72 | K | Joback Calculated Property |
| Tfus | 360.70 | K | Joback Calculated Property |
| Vc | 0.820 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [574.52; 655.19] | J/mol×K | [660.32; 855.72] | 
|
| Cp,gas | 574.52 | J/mol×K | 660.32 | Joback Calculated Property |
| Cp,gas | 590.10 | J/mol×K | 692.89 | Joback Calculated Property |
| Cp,gas | 604.78 | J/mol×K | 725.45 | Joback Calculated Property |
| Cp,gas | 618.59 | J/mol×K | 758.02 | Joback Calculated Property |
| Cp,gas | 631.58 | J/mol×K | 790.59 | Joback Calculated Property |
| Cp,gas | 643.77 | J/mol×K | 823.16 | Joback Calculated Property |
| Cp,gas | 655.19 | J/mol×K | 855.72 | Joback Calculated Property |
| η | [0.0001175; 0.0032395] | Pa×s | [360.70; 660.32] |
|
| η | 0.0032395 | Pa×s | 360.70 | Joback Calculated Property |
| η | 0.0013318 | Pa×s | 410.64 | Joback Calculated Property |
| η | 0.0006639 | Pa×s | 460.57 | Joback Calculated Property |
| η | 0.0003793 | Pa×s | 510.51 | Joback Calculated Property |
| η | 0.0002394 | Pa×s | 560.45 | Joback Calculated Property |
| η | 0.0001629 | Pa×s | 610.38 | Joback Calculated Property |
| η | 0.0001175 | Pa×s | 660.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, monochloride, 4-methylpent-2-yl ester.
Sources
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