- InChI
- InChI=1S/C27H41Cl3O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-33-25(31)27(2,3)26(32)34-24-22(29)19-21(28)20-23(24)30/h19-20H,4-18H2,1-3H3
- InChI Key
- HRRRBSWPUNKJLD-UHFFFAOYSA-N
- Formula
- C27H41Cl3O4
- SMILES
-
CCCCCCCCCCCCCCCCOC(=O)C(C)(C)C
(=O)Oc1c(Cl)cc(Cl)cc1Cl - Molecular Weight1
- 535.97
- 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° | -240.81 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -944.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 69.31 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 110.13 | kJ/mol | Joback Calculated Property |
| log10WS | -10.41 | Crippen Calculated Property | |
| logPoct/wat | 9.603 | Crippen Calculated Property | |
| McVol | 419.130 | ml/mol | McGowan Calculated Property |
| Pc | 805.25 | kPa | Joback Calculated Property |
| Inp | [3381.00; 3381.00] |
|
|
| Inp | 3381.00 | NIST | |
| Inp | 3381.00 | NIST | |
| Tboil | 1120.42 | K | Joback Calculated Property |
| Tc | 1378.77 | K | Joback Calculated Property |
| Tfus | 694.53 | K | Joback Calculated Property |
| Vc | 1.623 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1375.46; 1438.97] | J/mol×K | [1120.42; 1378.77] |
|
| Cp,gas | 1375.46 | J/mol×K | 1120.42 | Joback Calculated Property |
| Cp,gas | 1389.74 | J/mol×K | 1163.48 | Joback Calculated Property |
| Cp,gas | 1402.39 | J/mol×K | 1206.54 | Joback Calculated Property |
| Cp,gas | 1413.53 | J/mol×K | 1249.60 | Joback Calculated Property |
| Cp,gas | 1423.26 | J/mol×K | 1292.66 | Joback Calculated Property |
| Cp,gas | 1431.70 | J/mol×K | 1335.72 | Joback Calculated Property |
| Cp,gas | 1438.97 | J/mol×K | 1378.77 | Joback Calculated Property |
| η | [0.0000087; 0.0000877] | Pa×s | [694.53; 1120.42] |
|
| η | 0.0000877 | Pa×s | 694.53 | Joback Calculated Property |
| η | 0.0000499 | Pa×s | 765.51 | Joback Calculated Property |
| η | 0.0000312 | Pa×s | 836.49 | Joback Calculated Property |
| η | 0.0000210 | Pa×s | 907.48 | Joback Calculated Property |
| η | 0.0000150 | Pa×s | 978.46 | Joback Calculated Property |
| η | 0.0000112 | Pa×s | 1049.44 | Joback Calculated Property |
| η | 0.0000087 | Pa×s | 1120.42 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, hexadecyl 2,4,6-trichlorophenyl ester.
Sources
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