- InChI
- InChI=1S/C22H38O4/c1-2-3-4-5-6-12-17-25-21(23)19-15-10-11-16-20(19)22(24)26-18-13-8-7-9-14-18/h18-20H,2-17H2,1H3
- InChI Key
- KFPCRDLEQZNHQP-UHFFFAOYSA-N
- Formula
- C22H38O4
- SMILES
-
CCCCCCCCOC(=O)C1CCCCC1C(=O)OC1
CCCCC1 - 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° | -292.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -898.71 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.43 | kJ/mol | Joback Calculated Property |
| log10WS | -6.17 | Crippen Calculated Property | |
| logPoct/wat | 5.572 | Crippen Calculated Property | |
| McVol | 314.000 | ml/mol | McGowan Calculated Property |
| Pc | 1221.70 | kPa | Joback Calculated Property |
| Inp | [2596.00; 2596.00] |
|
|
| Inp | 2596.00 | NIST | |
| Inp | 2596.00 | NIST | |
| Tboil | 889.77 | K | Joback Calculated Property |
| Tc | 1102.80 | K | Joback Calculated Property |
| Tfus | 492.54 | K | Joback Calculated Property |
| Vc | 1.181 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1090.33; 1183.39] | J/mol×K | [889.77; 1102.80] |
|
| Cp,gas | 1090.33 | J/mol×K | 889.77 | Joback Calculated Property |
| Cp,gas | 1110.17 | J/mol×K | 925.28 | Joback Calculated Property |
| Cp,gas | 1128.24 | J/mol×K | 960.78 | Joback Calculated Property |
| Cp,gas | 1144.57 | J/mol×K | 996.29 | Joback Calculated Property |
| Cp,gas | 1159.18 | J/mol×K | 1031.79 | Joback Calculated Property |
| Cp,gas | 1172.11 | J/mol×K | 1067.30 | Joback Calculated Property |
| Cp,gas | 1183.39 | J/mol×K | 1102.80 | Joback Calculated Property |
| η | [0.0000552; 0.0009325] | Pa×s | [492.54; 889.77] |
|
| η | 0.0009325 | Pa×s | 492.54 | Joback Calculated Property |
| η | 0.0004403 | Pa×s | 558.75 | Joback Calculated Property |
| η | 0.0002437 | Pa×s | 624.95 | Joback Calculated Property |
| η | 0.0001511 | Pa×s | 691.15 | Joback Calculated Property |
| η | 0.0001018 | Pa×s | 757.36 | Joback Calculated Property |
| η | 0.0000731 | Pa×s | 823.56 | Joback Calculated Property |
| η | 0.0000552 | Pa×s | 889.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, cyclohexyl octyl ester.
Sources
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