- InChI
- InChI=1S/C21H29Cl3O4/c1-3-4-5-6-7-8-10-15(2)27-20(25)11-9-12-21(26)28-19-14-17(23)16(22)13-18(19)24/h13-15H,3-12H2,1-2H3
- InChI Key
- AZMBCGUTTFUYMJ-UHFFFAOYSA-N
- Formula
- C21H29Cl3O4
- SMILES
-
CCCCCCCCC(C)OC(=O)CCCC(=O)Oc1c
c(Cl)c(Cl)cc1Cl - Molecular Weight1
- 451.81
- 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° | -296.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -816.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 57.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 97.68 | kJ/mol | Joback Calculated Property |
| log10WS | -8.26 | Crippen Calculated Property | |
| logPoct/wat | 7.405 | Crippen Calculated Property | |
| McVol | 334.590 | ml/mol | McGowan Calculated Property |
| Pc | 1142.12 | kPa | Joback Calculated Property |
| Inp | [2946.00; 2946.00] |
|
|
| Inp | 2946.00 | NIST | |
| Inp | 2946.00 | NIST | |
| Tboil | 985.93 | K | Joback Calculated Property |
| Tc | 1208.79 | K | Joback Calculated Property |
| Tfus | 609.49 | K | Joback Calculated Property |
| Vc | 1.292 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1010.56; 1066.58] | J/mol×K | [985.93; 1208.79] |
|
| Cp,gas | 1010.56 | J/mol×K | 985.93 | Joback Calculated Property |
| Cp,gas | 1023.13 | J/mol×K | 1023.07 | Joback Calculated Property |
| Cp,gas | 1034.38 | J/mol×K | 1060.22 | Joback Calculated Property |
| Cp,gas | 1044.32 | J/mol×K | 1097.36 | Joback Calculated Property |
| Cp,gas | 1052.98 | J/mol×K | 1134.50 | Joback Calculated Property |
| Cp,gas | 1060.39 | J/mol×K | 1171.64 | Joback Calculated Property |
| Cp,gas | 1066.58 | J/mol×K | 1208.79 | Joback Calculated Property |
| η | [0.0000277; 0.0002412] | Pa×s | [609.49; 985.93] |
|
| η | 0.0002412 | Pa×s | 609.49 | Joback Calculated Property |
| η | 0.0001421 | Pa×s | 672.23 | Joback Calculated Property |
| η | 0.0000916 | Pa×s | 734.97 | Joback Calculated Property |
| η | 0.0000633 | Pa×s | 797.71 | Joback Calculated Property |
| η | 0.0000462 | Pa×s | 860.45 | Joback Calculated Property |
| η | 0.0000351 | Pa×s | 923.19 | Joback Calculated Property |
| η | 0.0000277 | Pa×s | 985.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, dec-2-yl 2,4,5-trichlorophenyl ester.
Sources
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