- InChI
- InChI=1S/C21H29Cl3O4/c22-15-7-5-3-1-2-4-6-8-16-27-19(25)13-10-14-20(26)28-18-12-9-11-17(23)21(18)24/h9,11-12H,1-8,10,13-16H2
- InChI Key
- MGGDMXNYLPMZOC-UHFFFAOYSA-N
- Formula
- C21H29Cl3O4
- SMILES
-
O=C(CCCC(=O)Oc1cccc(Cl)c1Cl)OC
CCCCCCCCCCl - 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° | -284.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -800.00 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 97.41 | kJ/mol | Joback Calculated Property |
| log10WS | -7.61 | Crippen Calculated Property | |
| logPoct/wat | 6.972 | Crippen Calculated Property | |
| McVol | 334.590 | ml/mol | McGowan Calculated Property |
| Pc | 1147.54 | kPa | Joback Calculated Property |
| Inp | [3297.00; 3297.00] |
|
|
| Inp | 3297.00 | NIST | |
| Inp | 3297.00 | NIST | |
| Tboil | 981.39 | K | Joback Calculated Property |
| Tc | 1202.67 | K | Joback Calculated Property |
| Tfus | 611.97 | K | Joback Calculated Property |
| Vc | 1.298 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1011.40; 1069.29] | J/mol×K | [981.39; 1202.67] |
|
| Cp,gas | 1011.40 | J/mol×K | 981.39 | Joback Calculated Property |
| Cp,gas | 1024.13 | J/mol×K | 1018.27 | Joback Calculated Property |
| Cp,gas | 1035.58 | J/mol×K | 1055.15 | Joback Calculated Property |
| Cp,gas | 1045.79 | J/mol×K | 1092.03 | Joback Calculated Property |
| Cp,gas | 1054.79 | J/mol×K | 1128.91 | Joback Calculated Property |
| Cp,gas | 1062.61 | J/mol×K | 1165.79 | Joback Calculated Property |
| Cp,gas | 1069.29 | J/mol×K | 1202.67 | Joback Calculated Property |
| η | [0.0000297; 0.0002508] | Pa×s | [611.97; 981.39] |
|
| η | 0.0002508 | Pa×s | 611.97 | Joback Calculated Property |
| η | 0.0001494 | Pa×s | 673.54 | Joback Calculated Property |
| η | 0.0000970 | Pa×s | 735.11 | Joback Calculated Property |
| η | 0.0000674 | Pa×s | 796.68 | Joback Calculated Property |
| η | 0.0000493 | Pa×s | 858.25 | Joback Calculated Property |
| η | 0.0000376 | Pa×s | 919.82 | Joback Calculated Property |
| η | 0.0000297 | Pa×s | 981.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 2,3-dichlorophenyl 10-chlorodecyl ester.
Sources
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