- InChI
- InChI=1S/C27H40Cl2O5/c1-4-7-8-9-10-11-12-13-14-15-16-17-33-25(31)27(5-2,6-3)26(32)34-24-21(20-30)18-22(28)19-23(24)29/h18-20H,4-17H2,1-3H3
- InChI Key
- YBXPEPIFHUCPMQ-UHFFFAOYSA-N
- Formula
- C27H40Cl2O5
- SMILES
-
CCCCCCCCCCCCCOC(=O)C(CC)(CC)C(
=O)Oc1c(Cl)cc(Cl)cc1C=O - Molecular Weight1
- 515.51
- 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° | -328.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1013.90 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 67.40 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 112.46 | kJ/mol | Joback Calculated Property |
| log10WS | -9.55 | Crippen Calculated Property | |
| logPoct/wat | 8.372 | Crippen Calculated Property | |
| McVol | 408.460 | ml/mol | McGowan Calculated Property |
| Pc | 858.47 | kPa | Joback Calculated Property |
| Inp | [3296.00; 3296.00] |
|
|
| Inp | 3296.00 | NIST | |
| Inp | 3296.00 | NIST | |
| Tboil | 1131.65 | K | Joback Calculated Property |
| Tc | 1394.61 | K | Joback Calculated Property |
| Tfus | 706.61 | K | Joback Calculated Property |
| Vc | 1.591 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1360.31; 1418.01] | J/mol×K | [1131.65; 1394.61] |
|
| Cp,gas | 1360.31 | J/mol×K | 1131.65 | Joback Calculated Property |
| Cp,gas | 1373.80 | J/mol×K | 1175.48 | Joback Calculated Property |
| Cp,gas | 1385.59 | J/mol×K | 1219.30 | Joback Calculated Property |
| Cp,gas | 1395.79 | J/mol×K | 1263.13 | Joback Calculated Property |
| Cp,gas | 1404.52 | J/mol×K | 1306.95 | Joback Calculated Property |
| Cp,gas | 1411.89 | J/mol×K | 1350.78 | Joback Calculated Property |
| Cp,gas | 1418.01 | J/mol×K | 1394.61 | Joback Calculated Property |
| η | [0.0000111; 0.0001057] | Pa×s | [706.61; 1131.65] |
|
| η | 0.0001057 | Pa×s | 706.61 | Joback Calculated Property |
| η | 0.0000612 | Pa×s | 777.45 | Joback Calculated Property |
| η | 0.0000388 | Pa×s | 848.29 | Joback Calculated Property |
| η | 0.0000264 | Pa×s | 919.13 | Joback Calculated Property |
| η | 0.0000189 | Pa×s | 989.97 | Joback Calculated Property |
| η | 0.0000142 | Pa×s | 1060.81 | Joback Calculated Property |
| η | 0.0000111 | Pa×s | 1131.65 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2,4-dichloro-6-formylphenyl tridecyl ester.
Sources
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