- InChI
- InChI=1S/C15H18Cl2O4/c1-10(2)9-20-13(18)7-4-8-14(19)21-12-6-3-5-11(16)15(12)17/h3,5-6,10H,4,7-9H2,1-2H3
- InChI Key
- OCKSXQXQUQEINJ-UHFFFAOYSA-N
- Formula
- C15H18Cl2O4
- SMILES
-
CC(C)COC(=O)CCCC(=O)Oc1cccc(Cl
)c1Cl - 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° | -325.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -665.70 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.31 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.28 | 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 | 1840.41 | kPa | Joback Calculated Property |
| Inp | [2320.00; 2320.00] |
|
|
| Inp | 2320.00 | NIST | |
| Inp | 2320.00 | NIST | |
| Tboil | 806.24 | K | Joback Calculated Property |
| Tc | 1020.76 | K | Joback Calculated Property |
| Tfus | 499.43 | K | Joback Calculated Property |
| Vc | 0.907 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [644.00; 705.08] | J/mol×K | [806.24; 1020.76] |
|
| Cp,gas | 644.00 | J/mol×K | 806.24 | Joback Calculated Property |
| Cp,gas | 656.65 | J/mol×K | 841.99 | Joback Calculated Property |
| Cp,gas | 668.30 | J/mol×K | 877.75 | Joback Calculated Property |
| Cp,gas | 678.96 | J/mol×K | 913.50 | Joback Calculated Property |
| Cp,gas | 688.64 | J/mol×K | 949.25 | Joback Calculated Property |
| Cp,gas | 697.34 | J/mol×K | 985.00 | Joback Calculated Property |
| Cp,gas | 705.08 | J/mol×K | 1020.76 | Joback Calculated Property |
| η | [0.0000769; 0.0006347] | Pa×s | [499.43; 806.24] |
|
| η | 0.0006347 | Pa×s | 499.43 | Joback Calculated Property |
| η | 0.0003791 | Pa×s | 550.57 | Joback Calculated Property |
| η | 0.0002472 | Pa×s | 601.70 | Joback Calculated Property |
| η | 0.0001723 | Pa×s | 652.84 | Joback Calculated Property |
| η | 0.0001266 | Pa×s | 703.97 | Joback Calculated Property |
| η | 0.0000970 | Pa×s | 755.11 | Joback Calculated Property |
| η | 0.0000769 | Pa×s | 806.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,3-dichlorophenyl isobutyl ester.
Sources
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