- InChI
- InChI=1S/C23H28Cl2O4/c1-4-7-8-11-14-28-21(26)23(5-2,6-3)22(27)29-20-17-13-10-9-12-16(17)18(24)15-19(20)25/h9-10,12-13,15H,4-8,11,14H2,1-3H3
- InChI Key
- KQBAYSSCGMGPQJ-UHFFFAOYSA-N
- Formula
- C23H28Cl2O4
- SMILES
-
CCCCCCOC(=O)C(CC)(CC)C(=O)Oc1c
(Cl)cc(Cl)c2ccccc12 - Molecular Weight1
- 439.37
- 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° | -155.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -654.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 51.77 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.48 | kJ/mol | Joback Calculated Property |
| log10WS | -8.19 | Crippen Calculated Property | |
| logPoct/wat | 6.982 | Crippen Calculated Property | |
| McVol | 331.070 | ml/mol | McGowan Calculated Property |
| Pc | 1224.27 | kPa | Joback Calculated Property |
| Inp | [2993.00; 2993.00] |
|
|
| Inp | 2993.00 | NIST | |
| Inp | 2993.00 | NIST | |
| Tboil | 1010.45 | K | Joback Calculated Property |
| Tc | 1242.21 | K | Joback Calculated Property |
| Tfus | 652.23 | K | Joback Calculated Property |
| Vc | 1.272 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1024.26; 1089.19] | J/mol×K | [1010.45; 1242.21] |
|
| Cp,gas | 1024.26 | J/mol×K | 1010.45 | Joback Calculated Property |
| Cp,gas | 1037.32 | J/mol×K | 1049.08 | Joback Calculated Property |
| Cp,gas | 1049.36 | J/mol×K | 1087.70 | Joback Calculated Property |
| Cp,gas | 1060.48 | J/mol×K | 1126.33 | Joback Calculated Property |
| Cp,gas | 1070.77 | J/mol×K | 1164.96 | Joback Calculated Property |
| Cp,gas | 1080.31 | J/mol×K | 1203.58 | Joback Calculated Property |
| Cp,gas | 1089.19 | J/mol×K | 1242.21 | Joback Calculated Property |
| η | [0.0000425; 0.0002664] | Pa×s | [652.23; 1010.45] |
|
| η | 0.0002664 | Pa×s | 652.23 | Joback Calculated Property |
| η | 0.0001725 | Pa×s | 711.93 | Joback Calculated Property |
| η | 0.0001195 | Pa×s | 771.64 | Joback Calculated Property |
| η | 0.0000873 | Pa×s | 831.34 | Joback Calculated Property |
| η | 0.0000665 | Pa×s | 891.04 | Joback Calculated Property |
| η | 0.0000524 | Pa×s | 950.75 | Joback Calculated Property |
| η | 0.0000425 | Pa×s | 1010.45 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2,4-dichloronaphth-1-yl hexyl ester.
Sources
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