- InChI
- InChI=1S/C15H18Cl2O4/c1-4-5-8-20-13(18)15(2,3)14(19)21-12-9-10(16)6-7-11(12)17/h6-7,9H,4-5,8H2,1-3H3
- InChI Key
- LSGVYAHOPOTMOU-UHFFFAOYSA-N
- Formula
- C15H18Cl2O4
- SMILES
-
CCCCOC(=O)C(C)(C)C(=O)Oc1cc(Cl
)ccc1Cl - Molecular Weight1
- 333.21
- 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° | -320.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -669.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 78.37 | kJ/mol | Joback Calculated Property |
| log10WS | -4.71 | Crippen Calculated Property | |
| logPoct/wat | 4.268 | Crippen Calculated Property | |
| McVol | 237.810 | ml/mol | McGowan Calculated Property |
| Pc | 1857.91 | kPa | Joback Calculated Property |
| Inp | [2039.00; 2039.00] |
|
|
| Inp | 2039.00 | NIST | |
| Inp | 2039.00 | NIST | |
| Tboil | 803.45 | K | Joback Calculated Property |
| Tc | 1023.67 | K | Joback Calculated Property |
| Tfus | 516.85 | K | Joback Calculated Property |
| Vc | 0.902 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [645.24; 706.62] | J/mol×K | [803.45; 1023.67] |
|
| Cp,gas | 645.24 | J/mol×K | 803.45 | Joback Calculated Property |
| Cp,gas | 657.91 | J/mol×K | 840.15 | Joback Calculated Property |
| Cp,gas | 669.56 | J/mol×K | 876.86 | Joback Calculated Property |
| Cp,gas | 680.23 | J/mol×K | 913.56 | Joback Calculated Property |
| Cp,gas | 689.94 | J/mol×K | 950.26 | Joback Calculated Property |
| Cp,gas | 698.73 | J/mol×K | 986.97 | Joback Calculated Property |
| Cp,gas | 706.62 | J/mol×K | 1023.67 | Joback Calculated Property |
| η | [0.0000671; 0.0005224] | Pa×s | [516.85; 803.45] |
|
| η | 0.0005224 | Pa×s | 516.85 | Joback Calculated Property |
| η | 0.0003211 | Pa×s | 564.62 | Joback Calculated Property |
| η | 0.0002129 | Pa×s | 612.38 | Joback Calculated Property |
| η | 0.0001498 | Pa×s | 660.15 | Joback Calculated Property |
| η | 0.0001106 | Pa×s | 707.92 | Joback Calculated Property |
| η | 0.0000848 | Pa×s | 755.68 | Joback Calculated Property |
| η | 0.0000671 | Pa×s | 803.45 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, butyl 2,5-dichlorophenyl ester.
Sources
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