- InChI
- InChI=1S/C22H38O4/c1-22(2,3)18-12-14-19(15-13-18)26-21(24)11-7-10-20(23)25-16-17-8-5-4-6-9-17/h17-19H,4-16H2,1-3H3
- InChI Key
- DEMOISFIAXGSHO-UHFFFAOYSA-N
- Formula
- C22H38O4
- SMILES
-
CC(C)(C)C1CCC(OC(=O)CCCC(=O)OC
C2CCCCC2)CC1 - Molecular Weight1
- 366.53
- 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° | -289.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -907.46 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.13 | kJ/mol | Joback Calculated Property |
| log10WS | -5.93 | Crippen Calculated Property | |
| logPoct/wat | 5.428 | Crippen Calculated Property | |
| McVol | 314.000 | ml/mol | McGowan Calculated Property |
| Pc | 1238.09 | kPa | Joback Calculated Property |
| Inp | [2707.00; 2707.00] |
|
|
| Inp | 2707.00 | NIST | |
| Inp | 2707.00 | NIST | |
| Tboil | 886.54 | K | Joback Calculated Property |
| Tc | 1105.42 | K | Joback Calculated Property |
| Tfus | 494.96 | K | Joback Calculated Property |
| Vc | 1.169 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1090.60; 1185.97] | J/mol×K | [886.54; 1105.42] |
|
| Cp,gas | 1090.60 | J/mol×K | 886.54 | Joback Calculated Property |
| Cp,gas | 1110.82 | J/mol×K | 923.02 | Joback Calculated Property |
| Cp,gas | 1129.24 | J/mol×K | 959.50 | Joback Calculated Property |
| Cp,gas | 1145.91 | J/mol×K | 995.98 | Joback Calculated Property |
| Cp,gas | 1160.89 | J/mol×K | 1032.46 | Joback Calculated Property |
| Cp,gas | 1174.22 | J/mol×K | 1068.94 | Joback Calculated Property |
| Cp,gas | 1185.97 | J/mol×K | 1105.42 | Joback Calculated Property |
| η | [0.0000430; 0.0008617] | Pa×s | [494.96; 886.54] |
|
| η | 0.0008617 | Pa×s | 494.96 | Joback Calculated Property |
| η | 0.0003908 | Pa×s | 560.22 | Joback Calculated Property |
| η | 0.0002090 | Pa×s | 625.49 | Joback Calculated Property |
| η | 0.0001258 | Pa×s | 690.75 | Joback Calculated Property |
| η | 0.0000827 | Pa×s | 756.01 | Joback Calculated Property |
| η | 0.0000581 | Pa×s | 821.28 | Joback Calculated Property |
| η | 0.0000430 | Pa×s | 886.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, cyclohexylmethyl trans-4-tert-butylcyclohexyl ester.
Sources
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