- InChI
- InChI=1S/C21H27Cl5O4/c1-4-5-6-7-8-9-10-11-12-29-19(27)21(2,3)20(28)30-18-16(25)14(23)13(22)15(24)17(18)26/h4-12H2,1-3H3
- InChI Key
- WIVDOBGEGNUACA-UHFFFAOYSA-N
- Formula
- C21H27Cl5O4
- SMILES
-
CCCCCCCCCCOC(=O)C(C)(C)C(=O)Oc
1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl - Molecular Weight1
- 520.70
- 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° | -334.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -874.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.87 | kJ/mol | Joback Calculated Property |
| log10WS | -9.27 | Crippen Calculated Property | |
| logPoct/wat | 8.569 | Crippen Calculated Property | |
| McVol | 359.070 | ml/mol | McGowan Calculated Property |
| Pc | 1073.57 | kPa | Joback Calculated Property |
| Inp | [3242.00; 3242.00] |
|
|
| Inp | 3242.00 | NIST | |
| Inp | 3242.00 | NIST | |
| Tboil | 1067.96 | K | Joback Calculated Property |
| Tc | 1307.87 | K | Joback Calculated Property |
| Tfus | 711.79 | K | Joback Calculated Property |
| Vc | 1.385 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1047.20; 1089.89] | J/mol×K | [1067.96; 1307.87] |
|
| Cp,gas | 1047.20 | J/mol×K | 1067.96 | Joback Calculated Property |
| Cp,gas | 1057.35 | J/mol×K | 1107.94 | Joback Calculated Property |
| Cp,gas | 1066.22 | J/mol×K | 1147.93 | Joback Calculated Property |
| Cp,gas | 1073.86 | J/mol×K | 1187.91 | Joback Calculated Property |
| Cp,gas | 1080.32 | J/mol×K | 1227.90 | Joback Calculated Property |
| Cp,gas | 1085.64 | J/mol×K | 1267.88 | Joback Calculated Property |
| Cp,gas | 1089.89 | J/mol×K | 1307.87 | Joback Calculated Property |
| η | [0.0000166; 0.0001030] | Pa×s | [711.79; 1067.96] |
|
| η | 0.0001030 | Pa×s | 711.79 | Joback Calculated Property |
| η | 0.0000676 | Pa×s | 771.15 | Joback Calculated Property |
| η | 0.0000471 | Pa×s | 830.51 | Joback Calculated Property |
| η | 0.0000344 | Pa×s | 889.88 | Joback Calculated Property |
| η | 0.0000262 | Pa×s | 949.24 | Joback Calculated Property |
| η | 0.0000206 | Pa×s | 1008.60 | Joback Calculated Property |
| η | 0.0000166 | Pa×s | 1067.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, decyl pentachlorophenyl ester.
Sources
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