- InChI
- InChI=1S/C12H21ClO4/c1-3-4-5-6-7-16-11(14)8-12(15)17-9-10(2)13/h10H,3-9H2,1-2H3
- InChI Key
- XHGYTOCDBVKYCB-UHFFFAOYSA-N
- Formula
- C12H21ClO4
- SMILES
- CCCCCCOC(=O)CC(=O)OCC(C)Cl
- Molecular Weight1
- 264.75
- 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° | -432.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -801.63 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.08 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.62 | kJ/mol | Joback Calculated Property |
| log10WS | -2.84 | Crippen Calculated Property | |
| logPoct/wat | 2.671 | Crippen Calculated Property | |
| McVol | 207.060 | ml/mol | McGowan Calculated Property |
| Pc | 1878.90 | kPa | Joback Calculated Property |
| Inp | 1722.00 | NIST | |
| Tboil | 663.53 | K | Joback Calculated Property |
| Tc | 848.07 | K | Joback Calculated Property |
| Tfus | 384.24 | K | Joback Calculated Property |
| Vc | 0.798 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [545.79; 619.82] | J/mol×K | [663.53; 848.07] | 
|
| Cp,gas | 545.79 | J/mol×K | 663.53 | Joback Calculated Property |
| Cp,gas | 559.86 | J/mol×K | 694.29 | Joback Calculated Property |
| Cp,gas | 573.23 | J/mol×K | 725.04 | Joback Calculated Property |
| Cp,gas | 585.92 | J/mol×K | 755.80 | Joback Calculated Property |
| Cp,gas | 597.91 | J/mol×K | 786.56 | Joback Calculated Property |
| Cp,gas | 609.21 | J/mol×K | 817.32 | Joback Calculated Property |
| Cp,gas | 619.82 | J/mol×K | 848.07 | Joback Calculated Property |
| η | [0.0001288; 0.0017583] | Pa×s | [384.24; 663.53] |
|
| η | 0.0017583 | Pa×s | 384.24 | Joback Calculated Property |
| η | 0.0008988 | Pa×s | 430.79 | Joback Calculated Property |
| η | 0.0005237 | Pa×s | 477.34 | Joback Calculated Property |
| η | 0.0003359 | Pa×s | 523.88 | Joback Calculated Property |
| η | 0.0002316 | Pa×s | 570.43 | Joback Calculated Property |
| η | 0.0001690 | Pa×s | 616.98 | Joback Calculated Property |
| η | 0.0001288 | Pa×s | 663.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Malonic acid, 2-chloropropyl hexyl ester.
Sources
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