- InChI
- InChI=1S/C26H41ClO4/c1-5-8-9-10-11-12-13-14-15-16-19-30-24(28)26(6-2,7-3)25(29)31-22-17-18-23(27)21(4)20-22/h17-18,20H,5-16,19H2,1-4H3
- InChI Key
- HHGCVFVKQDLRKK-UHFFFAOYSA-N
- Formula
- C26H41ClO4
- SMILES
-
CCCCCCCCCCCCOC(=O)C(CC)(CC)C(=
O)Oc1ccc(Cl)c(C)c1 - Molecular Weight1
- 453.05
- 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° | -215.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -880.47 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 58.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.47 | kJ/mol | Joback Calculated Property |
| log10WS | -8.68 | Crippen Calculated Property | |
| logPoct/wat | 7.824 | Crippen Calculated Property | |
| McVol | 380.560 | ml/mol | McGowan Calculated Property |
| Pc | 896.95 | kPa | Joback Calculated Property |
| Inp | [2941.00; 2941.00] |
|
|
| Inp | 2941.00 | NIST | |
| Inp | 2941.00 | NIST | |
| Tboil | 1017.70 | K | Joback Calculated Property |
| Tc | 1246.25 | K | Joback Calculated Property |
| Tfus | 610.90 | K | Joback Calculated Property |
| Vc | 1.470 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1268.95; 1346.43] | J/mol×K | [1017.70; 1246.25] |
|
| Cp,gas | 1268.95 | J/mol×K | 1017.70 | Joback Calculated Property |
| Cp,gas | 1285.25 | J/mol×K | 1055.79 | Joback Calculated Property |
| Cp,gas | 1300.09 | J/mol×K | 1093.88 | Joback Calculated Property |
| Cp,gas | 1313.56 | J/mol×K | 1131.97 | Joback Calculated Property |
| Cp,gas | 1325.72 | J/mol×K | 1170.06 | Joback Calculated Property |
| Cp,gas | 1336.65 | J/mol×K | 1208.15 | Joback Calculated Property |
| Cp,gas | 1346.43 | J/mol×K | 1246.25 | Joback Calculated Property |
| η | [0.0000147; 0.0001813] | Pa×s | [610.90; 1017.70] |
|
| η | 0.0001813 | Pa×s | 610.90 | Joback Calculated Property |
| η | 0.0000968 | Pa×s | 678.70 | Joback Calculated Property |
| η | 0.0000579 | Pa×s | 746.50 | Joback Calculated Property |
| η | 0.0000377 | Pa×s | 814.30 | Joback Calculated Property |
| η | 0.0000263 | Pa×s | 882.10 | Joback Calculated Property |
| η | 0.0000193 | Pa×s | 949.90 | Joback Calculated Property |
| η | 0.0000147 | Pa×s | 1017.70 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 4-chloro-3-methylphenyl dodecyl ester.
Sources
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