- InChI
- InChI=1S/C21H31ClO6/c1-25-17-11-9-12-18(26-2)21(17)28-20(24)14-10-13-19(23)27-16-8-6-4-3-5-7-15-22/h9,11-12H,3-8,10,13-16H2,1-2H3
- InChI Key
- PGSCOAIZQAJRJI-UHFFFAOYSA-N
- Formula
- C21H31ClO6
- SMILES
-
COc1cccc(OC)c1OC(=O)CCCC(=O)OC
CCCCCCCCl - Molecular Weight1
- 414.92
- 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° | -470.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1032.96 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 55.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 93.46 | kJ/mol | Joback Calculated Property |
| log10WS | -5.65 | Crippen Calculated Property | |
| logPoct/wat | 4.902 | Crippen Calculated Property | |
| McVol | 321.850 | ml/mol | McGowan Calculated Property |
| Pc | 1179.28 | kPa | Joback Calculated Property |
| Inp | 3075.00 | NIST | |
| Tboil | 951.37 | K | Joback Calculated Property |
| Tc | 1165.65 | K | Joback Calculated Property |
| Tfus | 596.59 | K | Joback Calculated Property |
| Vc | 1.236 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1020.12; 1079.64] | J/mol×K | [951.37; 1165.65] | 
|
| Cp,gas | 1020.12 | J/mol×K | 951.37 | Joback Calculated Property |
| Cp,gas | 1033.85 | J/mol×K | 987.08 | Joback Calculated Property |
| Cp,gas | 1046.06 | J/mol×K | 1022.80 | Joback Calculated Property |
| Cp,gas | 1056.75 | J/mol×K | 1058.51 | Joback Calculated Property |
| Cp,gas | 1065.91 | J/mol×K | 1094.22 | Joback Calculated Property |
| Cp,gas | 1073.54 | J/mol×K | 1129.94 | Joback Calculated Property |
| Cp,gas | 1079.64 | J/mol×K | 1165.65 | Joback Calculated Property |
| η | [0.0000229; 0.0001880] | Pa×s | [596.59; 951.37] |
|
| η | 0.0001880 | Pa×s | 596.59 | Joback Calculated Property |
| η | 0.0001130 | Pa×s | 655.72 | Joback Calculated Property |
| η | 0.0000738 | Pa×s | 714.85 | Joback Calculated Property |
| η | 0.0000515 | Pa×s | 773.98 | Joback Calculated Property |
| η | 0.0000378 | Pa×s | 833.11 | Joback Calculated Property |
| η | 0.0000289 | Pa×s | 892.24 | Joback Calculated Property |
| η | 0.0000229 | Pa×s | 951.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 8-chlorooctyl 2,6-dimethoxyphenyl ester.
Sources
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