- InChI
- InChI=1S/C20H28O4/c1-15-8-6-11-18(16(15)2)24-20(22)13-7-12-19(21)23-14-17-9-4-3-5-10-17/h6,8,11,17H,3-5,7,9-10,12-14H2,1-2H3
- InChI Key
- KLRYPRLQCNNICL-UHFFFAOYSA-N
- Formula
- C20H28O4
- SMILES
-
Cc1cccc(OC(=O)CCCC(=O)OCC2CCCC
C2)c1C - Molecular Weight1
- 332.43
- 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° | -232.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -677.82 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.45 | kJ/mol | Joback Calculated Property |
| log10WS | -5.44 | Crippen Calculated Property | |
| logPoct/wat | 4.503 | Crippen Calculated Property | |
| McVol | 272.920 | ml/mol | McGowan Calculated Property |
| Pc | 1550.00 | kPa | Joback Calculated Property |
| Inp | [2603.00; 2603.00] |
|
|
| Inp | 2603.00 | NIST | |
| Inp | 2603.00 | NIST | |
| Tboil | 865.77 | K | Joback Calculated Property |
| Tc | 1085.78 | K | Joback Calculated Property |
| Tfus | 518.32 | K | Joback Calculated Property |
| Vc | 1.028 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [872.20; 951.38] | J/mol×K | [865.77; 1085.78] |
|
| Cp,gas | 872.20 | J/mol×K | 865.77 | Joback Calculated Property |
| Cp,gas | 889.04 | J/mol×K | 902.44 | Joback Calculated Property |
| Cp,gas | 904.39 | J/mol×K | 939.11 | Joback Calculated Property |
| Cp,gas | 918.27 | J/mol×K | 975.77 | Joback Calculated Property |
| Cp,gas | 930.72 | J/mol×K | 1012.44 | Joback Calculated Property |
| Cp,gas | 941.74 | J/mol×K | 1049.11 | Joback Calculated Property |
| Cp,gas | 951.38 | J/mol×K | 1085.78 | Joback Calculated Property |
| η | [0.0000576; 0.0005810] | Pa×s | [518.32; 865.77] |
|
| η | 0.0005810 | Pa×s | 518.32 | Joback Calculated Property |
| η | 0.0003257 | Pa×s | 576.23 | Joback Calculated Property |
| η | 0.0002029 | Pa×s | 634.14 | Joback Calculated Property |
| η | 0.0001368 | Pa×s | 692.04 | Joback Calculated Property |
| η | 0.0000981 | Pa×s | 749.95 | Joback Calculated Property |
| η | 0.0000737 | Pa×s | 807.86 | Joback Calculated Property |
| η | 0.0000576 | Pa×s | 865.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, cyclohexylmethyl 2,3-dimethylphenyl ester.
Sources
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