- InChI
- InChI=1S/C21H38O4/c1-2-3-4-5-6-7-11-17-24-20(22)15-12-16-21(23)25-18-19-13-9-8-10-14-19/h19H,2-18H2,1H3
- InChI Key
- JKZKJTIPURQYHX-UHFFFAOYSA-N
- Formula
- C21H38O4
- SMILES
-
CCCCCCCCCOC(=O)CCCC(=O)OCC1CCC
CC1 - Molecular Weight1
- 354.52
- 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° | -317.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -912.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 47.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.08 | kJ/mol | Joback Calculated Property |
| log10WS | -5.99 | Crippen Calculated Property | |
| logPoct/wat | 5.574 | Crippen Calculated Property | |
| McVol | 310.770 | ml/mol | McGowan Calculated Property |
| Pc | 1159.29 | kPa | Joback Calculated Property |
| Inp | [2576.00; 2576.00] |
|
|
| Inp | 2576.00 | NIST | |
| Inp | 2576.00 | NIST | |
| Tboil | 852.01 | K | Joback Calculated Property |
| Tc | 1049.36 | K | Joback Calculated Property |
| Tfus | 478.13 | K | Joback Calculated Property |
| Vc | 1.192 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1027.64; 1122.19] | J/mol×K | [852.01; 1049.36] |
|
| Cp,gas | 1027.64 | J/mol×K | 852.01 | Joback Calculated Property |
| Cp,gas | 1046.67 | J/mol×K | 884.90 | Joback Calculated Property |
| Cp,gas | 1064.35 | J/mol×K | 917.79 | Joback Calculated Property |
| Cp,gas | 1080.72 | J/mol×K | 950.68 | Joback Calculated Property |
| Cp,gas | 1095.80 | J/mol×K | 983.58 | Joback Calculated Property |
| Cp,gas | 1109.61 | J/mol×K | 1016.47 | Joback Calculated Property |
| Cp,gas | 1122.19 | J/mol×K | 1049.36 | Joback Calculated Property |
| η | [0.0000476; 0.0008554] | Pa×s | [478.13; 852.01] |
|
| η | 0.0008554 | Pa×s | 478.13 | Joback Calculated Property |
| η | 0.0004003 | Pa×s | 540.44 | Joback Calculated Property |
| η | 0.0002192 | Pa×s | 602.76 | Joback Calculated Property |
| η | 0.0001344 | Pa×s | 665.07 | Joback Calculated Property |
| η | 0.0000896 | Pa×s | 727.38 | Joback Calculated Property |
| η | 0.0000637 | Pa×s | 789.70 | Joback Calculated Property |
| η | 0.0000476 | Pa×s | 852.01 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, cyclohexylmethyl nonyl ester.
Sources
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