- InChI
- InChI=1S/C20H22Cl2O4/c1-4-11-25-18(23)20(5-2,6-3)19(24)26-17-14-10-8-7-9-13(14)15(21)12-16(17)22/h7-10,12H,4-6,11H2,1-3H3
- InChI Key
- XPLQKVHODHWSLY-UHFFFAOYSA-N
- Formula
- C20H22Cl2O4
- SMILES
-
CCCOC(=O)C(CC)(CC)C(=O)Oc1c(Cl
)cc(Cl)c2ccccc12 - Molecular Weight1
- 397.29
- 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° | -181.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -592.77 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.80 | kJ/mol | Joback Calculated Property |
| log10WS | -6.93 | Crippen Calculated Property | |
| logPoct/wat | 5.812 | Crippen Calculated Property | |
| McVol | 288.800 | ml/mol | McGowan Calculated Property |
| Pc | 1514.03 | kPa | Joback Calculated Property |
| Inp | [2703.00; 2703.00] |
|
|
| Inp | 2703.00 | NIST | |
| Inp | 2703.00 | NIST | |
| Tboil | 941.81 | K | Joback Calculated Property |
| Tc | 1171.95 | K | Joback Calculated Property |
| Tfus | 618.42 | K | Joback Calculated Property |
| Vc | 1.105 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [847.52; 907.96] | J/mol×K | [941.81; 1171.95] |
|
| Cp,gas | 847.52 | J/mol×K | 941.81 | Joback Calculated Property |
| Cp,gas | 859.80 | J/mol×K | 980.17 | Joback Calculated Property |
| Cp,gas | 871.10 | J/mol×K | 1018.52 | Joback Calculated Property |
| Cp,gas | 881.49 | J/mol×K | 1056.88 | Joback Calculated Property |
| Cp,gas | 891.05 | J/mol×K | 1095.24 | Joback Calculated Property |
| Cp,gas | 899.85 | J/mol×K | 1133.59 | Joback Calculated Property |
| Cp,gas | 907.96 | J/mol×K | 1171.95 | Joback Calculated Property |
| η | [0.0000660; 0.0003678] | Pa×s | [618.42; 941.81] |
|
| η | 0.0003678 | Pa×s | 618.42 | Joback Calculated Property |
| η | 0.0002463 | Pa×s | 672.32 | Joback Calculated Property |
| η | 0.0001750 | Pa×s | 726.22 | Joback Calculated Property |
| η | 0.0001303 | Pa×s | 780.12 | Joback Calculated Property |
| η | 0.0001009 | Pa×s | 834.01 | Joback Calculated Property |
| η | 0.0000805 | Pa×s | 887.91 | Joback Calculated Property |
| η | 0.0000660 | Pa×s | 941.81 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2,4-dichloronaphth-1-yl propyl ester.
Sources
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