- InChI
- InChI=1S/C17H30O4/c1-17(2,3)13-21-16(19)11-7-10-15(18)20-12-14-8-5-4-6-9-14/h14H,4-13H2,1-3H3
- InChI Key
- MLKCIIWAILWIFW-UHFFFAOYSA-N
- Formula
- C17H30O4
- SMILES
-
CC(C)(C)COC(=O)CCCC(=O)OCC1CCC
CC1 - Molecular Weight1
- 298.42
- 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° | -348.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -838.24 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.78 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.88 | kJ/mol | Joback Calculated Property |
| log10WS | -4.08 | Crippen Calculated Property | |
| logPoct/wat | 3.870 | Crippen Calculated Property | |
| McVol | 254.410 | ml/mol | McGowan Calculated Property |
| Pc | 1557.35 | kPa | Joback Calculated Property |
| Inp | [2032.00; 2032.00] |
|
|
| Inp | 2032.00 | NIST | |
| Inp | 2032.00 | NIST | |
| Tboil | 757.26 | K | Joback Calculated Property |
| Tc | 959.95 | K | Joback Calculated Property |
| Tfus | 435.47 | K | Joback Calculated Property |
| Vc | 0.958 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [788.62; 883.98] | J/mol×K | [757.26; 959.95] |
|
| Cp,gas | 788.62 | J/mol×K | 757.26 | Joback Calculated Property |
| Cp,gas | 807.54 | J/mol×K | 791.04 | Joback Calculated Property |
| Cp,gas | 825.21 | J/mol×K | 824.82 | Joback Calculated Property |
| Cp,gas | 841.65 | J/mol×K | 858.61 | Joback Calculated Property |
| Cp,gas | 856.91 | J/mol×K | 892.39 | Joback Calculated Property |
| Cp,gas | 871.00 | J/mol×K | 926.17 | Joback Calculated Property |
| Cp,gas | 883.98 | J/mol×K | 959.95 | Joback Calculated Property |
| η | [0.0000690; 0.0013049] | Pa×s | [435.47; 757.26] |
|
| η | 0.0013049 | Pa×s | 435.47 | Joback Calculated Property |
| η | 0.0006111 | Pa×s | 489.10 | Joback Calculated Property |
| η | 0.0003325 | Pa×s | 542.73 | Joback Calculated Property |
| η | 0.0002018 | Pa×s | 596.37 | Joback Calculated Property |
| η | 0.0001330 | Pa×s | 650.00 | Joback Calculated Property |
| η | 0.0000935 | Pa×s | 703.63 | Joback Calculated Property |
| η | 0.0000690 | Pa×s | 757.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, cyclohexylmethyl neopentyl ester.
Sources
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