- InChI
- InChI=1S/C32H58O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-26-35-31(33)29-24-19-20-25-30(29)32(34)36-27-22-23-28(2)3/h19-20,28-30H,4-18,21-27H2,1-3H3
- InChI Key
- NNNUUHJTWVWLCP-UHFFFAOYSA-N
- Formula
- C32H58O4
- SMILES
-
CCCCCCCCCCCCCCCCCCOC(=O)C1CC=C
CC1C(=O)OCCCC(C)C - Molecular Weight1
- 506.80
- 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° | -205.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1106.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 74.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.16 | kJ/mol | Joback Calculated Property |
| log10WS | -9.97 | Crippen Calculated Property | |
| logPoct/wat | 9.353 | Crippen Calculated Property | |
| McVol | 461.460 | ml/mol | McGowan Calculated Property |
| Pc | 630.66 | kPa | Joback Calculated Property |
| Inp | [3451.00; 3451.00] |
|
|
| Inp | 3451.00 | NIST | |
| Inp | 3451.00 | NIST | |
| Tboil | 1097.74 | K | Joback Calculated Property |
| Tc | 1369.98 | K | Joback Calculated Property |
| Tfus | 583.62 | K | Joback Calculated Property |
| Vc | 1.788 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1701.51; 1786.28] | J/mol×K | [1097.74; 1369.98] |
|
| Cp,gas | 1701.51 | J/mol×K | 1097.74 | Joback Calculated Property |
| Cp,gas | 1722.37 | J/mol×K | 1143.11 | Joback Calculated Property |
| Cp,gas | 1740.37 | J/mol×K | 1188.49 | Joback Calculated Property |
| Cp,gas | 1755.63 | J/mol×K | 1233.86 | Joback Calculated Property |
| Cp,gas | 1768.28 | J/mol×K | 1279.23 | Joback Calculated Property |
| Cp,gas | 1778.46 | J/mol×K | 1324.61 | Joback Calculated Property |
| Cp,gas | 1786.28 | J/mol×K | 1369.98 | Joback Calculated Property |
| η | [0.0000116; 0.0002618] | Pa×s | [583.62; 1097.74] |
|
| η | 0.0002618 | Pa×s | 583.62 | Joback Calculated Property |
| η | 0.0001118 | Pa×s | 669.31 | Joback Calculated Property |
| η | 0.0000579 | Pa×s | 754.99 | Joback Calculated Property |
| η | 0.0000343 | Pa×s | 840.68 | Joback Calculated Property |
| η | 0.0000224 | Pa×s | 926.37 | Joback Calculated Property |
| η | 0.0000157 | Pa×s | 1012.05 | Joback Calculated Property |
| η | 0.0000116 | Pa×s | 1097.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-Cyclohex-4-en-1,2-dicarboxylic acid, isohexyl octadecyl ester.
Sources
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