- InChI
- InChI=1S/C22H41ClO4/c1-4-7-8-12-15-18-26-20(24)22(5-2,6-3)21(25)27-19-16-13-10-9-11-14-17-23/h4-19H2,1-3H3
- InChI Key
- VUJOTVLZAGTTDX-UHFFFAOYSA-N
- Formula
- C22H41ClO4
- SMILES
-
CCCCCCCOC(=O)C(CC)(CC)C(=O)OCC
CCCCCCCl - Molecular Weight1
- 405.01
- 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° | -342.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1011.50 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.97 | kJ/mol | Joback Calculated Property |
| log10WS | -6.67 | Crippen Calculated Property | |
| logPoct/wat | 6.429 | Crippen Calculated Property | |
| McVol | 347.960 | ml/mol | McGowan Calculated Property |
| Pc | 943.26 | kPa | Joback Calculated Property |
| Inp | [2570.00; 2570.00] |
|
|
| Inp | 2570.00 | NIST | |
| Inp | 2570.00 | NIST | |
| Tboil | 889.54 | K | Joback Calculated Property |
| Tc | 1089.21 | K | Joback Calculated Property |
| Tfus | 514.36 | K | Joback Calculated Property |
| Vc | 1.353 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1123.76; 1214.92] | J/mol×K | [889.54; 1089.21] |
|
| Cp,gas | 1123.76 | J/mol×K | 889.54 | Joback Calculated Property |
| Cp,gas | 1141.80 | J/mol×K | 922.82 | Joback Calculated Property |
| Cp,gas | 1158.65 | J/mol×K | 956.10 | Joback Calculated Property |
| Cp,gas | 1174.33 | J/mol×K | 989.37 | Joback Calculated Property |
| Cp,gas | 1188.91 | J/mol×K | 1022.65 | Joback Calculated Property |
| Cp,gas | 1202.42 | J/mol×K | 1055.93 | Joback Calculated Property |
| Cp,gas | 1214.92 | J/mol×K | 1089.21 | Joback Calculated Property |
| η | [0.0000262; 0.0004739] | Pa×s | [514.36; 889.54] |
|
| η | 0.0004739 | Pa×s | 514.36 | Joback Calculated Property |
| η | 0.0002252 | Pa×s | 576.89 | Joback Calculated Property |
| η | 0.0001238 | Pa×s | 639.42 | Joback Calculated Property |
| η | 0.0000757 | Pa×s | 701.95 | Joback Calculated Property |
| η | 0.0000502 | Pa×s | 764.48 | Joback Calculated Property |
| η | 0.0000354 | Pa×s | 827.01 | Joback Calculated Property |
| η | 0.0000262 | Pa×s | 889.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 8-chlorooctyl heptyl ester.
Sources
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