- InChI
- InChI=1S/C22H33ClO4/c1-16(2)7-5-8-17(3)13-14-26-21(24)9-6-10-22(25)27-19-11-12-20(23)18(4)15-19/h11-12,15-17H,5-10,13-14H2,1-4H3
- InChI Key
- ZJEPQWUZCQRSNP-UHFFFAOYSA-N
- Formula
- C22H33ClO4
- SMILES
-
Cc1cc(OC(=O)CCCC(=O)OCCC(C)CCC
C(C)C)ccc1Cl - Molecular Weight1
- 396.95
- 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° | -257.14 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -799.72 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.09 | kJ/mol | Joback Calculated Property |
| log10WS | -6.77 | Crippen Calculated Property | |
| logPoct/wat | 6.120 | Crippen Calculated Property | |
| McVol | 324.200 | ml/mol | McGowan Calculated Property |
| Pc | 1142.89 | kPa | Joback Calculated Property |
| Inp | [2792.00; 2792.00] |
|
|
| Inp | 2792.00 | NIST | |
| Inp | 2792.00 | NIST | |
| Tboil | 928.53 | K | Joback Calculated Property |
| Tc | 1140.93 | K | Joback Calculated Property |
| Tfus | 533.40 | K | Joback Calculated Property |
| Vc | 1.244 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1024.48; 1097.26] | J/mol×K | [928.53; 1140.93] |
|
| Cp,gas | 1024.48 | J/mol×K | 928.53 | Joback Calculated Property |
| Cp,gas | 1039.83 | J/mol×K | 963.93 | Joback Calculated Property |
| Cp,gas | 1053.86 | J/mol×K | 999.33 | Joback Calculated Property |
| Cp,gas | 1066.58 | J/mol×K | 1034.73 | Joback Calculated Property |
| Cp,gas | 1078.04 | J/mol×K | 1070.13 | Joback Calculated Property |
| Cp,gas | 1088.25 | J/mol×K | 1105.53 | Joback Calculated Property |
| Cp,gas | 1097.26 | J/mol×K | 1140.93 | Joback Calculated Property |
| η | [0.0000299; 0.0004146] | Pa×s | [533.40; 928.53] |
|
| η | 0.0004146 | Pa×s | 533.40 | Joback Calculated Property |
| η | 0.0002102 | Pa×s | 599.26 | Joback Calculated Property |
| η | 0.0001219 | Pa×s | 665.11 | Joback Calculated Property |
| η | 0.0000780 | Pa×s | 730.97 | Joback Calculated Property |
| η | 0.0000537 | Pa×s | 796.82 | Joback Calculated Property |
| η | 0.0000392 | Pa×s | 862.67 | Joback Calculated Property |
| η | 0.0000299 | Pa×s | 928.53 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 4-chloro-3-methylphenyl 3,7-dimethyloctyl ester.
Sources
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