- InChI
- InChI=1S/C20H29ClO4/c1-6-11-16(14(4)5)24-18(22)20(7-2,8-3)19(23)25-17-13-10-9-12-15(17)21/h9-10,12-14,16H,6-8,11H2,1-5H3
- InChI Key
- WPRTVIXEATXAFN-UHFFFAOYSA-N
- Formula
- C20H29ClO4
- SMILES
-
CCCC(OC(=O)C(CC)(CC)C(=O)Oc1cc
ccc1Cl)C(C)C - Molecular Weight1
- 368.89
- 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° | -261.51 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -755.72 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.68 | kJ/mol | Joback Calculated Property |
| log10WS | -5.98 | Crippen Calculated Property | |
| logPoct/wat | 5.420 | Crippen Calculated Property | |
| McVol | 296.020 | ml/mol | McGowan Calculated Property |
| Pc | 1339.80 | kPa | Joback Calculated Property |
| Inp | [2208.00; 2208.00] |
|
|
| Inp | 2208.00 | NIST | |
| Inp | 2208.00 | NIST | |
| Tboil | 874.56 | K | Joback Calculated Property |
| Tc | 1088.45 | K | Joback Calculated Property |
| Tfus | 500.76 | K | Joback Calculated Property |
| Vc | 1.121 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [906.78; 981.50] | J/mol×K | [874.56; 1088.45] |
|
| Cp,gas | 906.78 | J/mol×K | 874.56 | Joback Calculated Property |
| Cp,gas | 922.11 | J/mol×K | 910.21 | Joback Calculated Property |
| Cp,gas | 936.21 | J/mol×K | 945.86 | Joback Calculated Property |
| Cp,gas | 949.16 | J/mol×K | 981.51 | Joback Calculated Property |
| Cp,gas | 960.99 | J/mol×K | 1017.16 | Joback Calculated Property |
| Cp,gas | 971.76 | J/mol×K | 1052.80 | Joback Calculated Property |
| Cp,gas | 981.50 | J/mol×K | 1088.45 | Joback Calculated Property |
| η | [0.0000309; 0.0005631] | Pa×s | [500.76; 874.56] |
|
| η | 0.0005631 | Pa×s | 500.76 | Joback Calculated Property |
| η | 0.0002657 | Pa×s | 563.06 | Joback Calculated Property |
| η | 0.0001456 | Pa×s | 625.36 | Joback Calculated Property |
| η | 0.0000890 | Pa×s | 687.66 | Joback Calculated Property |
| η | 0.0000590 | Pa×s | 749.96 | Joback Calculated Property |
| η | 0.0000417 | Pa×s | 812.26 | Joback Calculated Property |
| η | 0.0000309 | Pa×s | 874.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2-chlorophenyl 2-methylhex-3-yl ester.
Sources
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