- InChI
- InChI=1S/C17H30O4/c1-12(2)8-7-11-20-16(18)14-9-5-6-10-15(14)17(19)21-13(3)4/h12-15H,5-11H2,1-4H3
- InChI Key
- ONUIWTQGPQZMLW-UHFFFAOYSA-N
- Formula
- C17H30O4
- SMILES
-
CC(C)CCCOC(=O)C1CCCCC1C(=O)OC(
C)C - 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° | -363.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -860.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.09 | kJ/mol | Joback Calculated Property |
| log10WS | -3.95 | Crippen Calculated Property | |
| logPoct/wat | 3.724 | Crippen Calculated Property | |
| McVol | 254.410 | ml/mol | McGowan Calculated Property |
| Pc | 1514.03 | kPa | Joback Calculated Property |
| Inp | [2102.00; 2102.00] |
|
|
| Inp | 2102.00 | NIST | |
| Inp | 2102.00 | NIST | |
| Tboil | 754.94 | K | Joback Calculated Property |
| Tc | 955.18 | K | Joback Calculated Property |
| Tfus | 398.81 | K | Joback Calculated Property |
| Vc | 0.956 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [790.61; 888.42] | J/mol×K | [754.94; 955.18] |
|
| Cp,gas | 790.61 | J/mol×K | 754.94 | Joback Calculated Property |
| Cp,gas | 810.05 | J/mol×K | 788.31 | Joback Calculated Property |
| Cp,gas | 828.22 | J/mol×K | 821.69 | Joback Calculated Property |
| Cp,gas | 845.14 | J/mol×K | 855.06 | Joback Calculated Property |
| Cp,gas | 860.80 | J/mol×K | 888.43 | Joback Calculated Property |
| Cp,gas | 875.23 | J/mol×K | 921.80 | Joback Calculated Property |
| Cp,gas | 888.42 | J/mol×K | 955.18 | Joback Calculated Property |
| η | [0.0000896; 0.0019397] | Pa×s | [398.81; 754.94] |
|
| η | 0.0019397 | Pa×s | 398.81 | Joback Calculated Property |
| η | 0.0008336 | Pa×s | 458.17 | Joback Calculated Property |
| η | 0.0004348 | Pa×s | 517.52 | Joback Calculated Property |
| η | 0.0002593 | Pa×s | 576.88 | Joback Calculated Property |
| η | 0.0001703 | Pa×s | 636.23 | Joback Calculated Property |
| η | 0.0001202 | Pa×s | 695.59 | Joback Calculated Property |
| η | 0.0000896 | Pa×s | 754.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, isohexyl isopropyl ester.
Sources
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