- InChI
- InChI=1S/C22H38O4/c1-4-5-6-7-8-11-16-25-21(23)19-14-9-10-15-20(19)22(24)26-17-12-13-18(2)3/h9-10,18-20H,4-8,11-17H2,1-3H3
- InChI Key
- LGUUOHIIBBPLKC-UHFFFAOYSA-N
- Formula
- C22H38O4
- SMILES
-
CCCCCCCCOC(=O)C1CC=CCC1C(=O)OC
CCC(C)C - 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° | -289.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -900.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.91 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.90 | kJ/mol | Joback Calculated Property |
| log10WS | -5.78 | Crippen Calculated Property | |
| logPoct/wat | 5.452 | Crippen Calculated Property | |
| McVol | 320.560 | ml/mol | McGowan Calculated Property |
| Pc | 1094.99 | kPa | Joback Calculated Property |
| Inp | [2440.00; 2440.00] |
|
|
| Inp | 2440.00 | NIST | |
| Inp | 2440.00 | NIST | |
| Tboil | 868.94 | K | Joback Calculated Property |
| Tc | 1069.26 | K | Joback Calculated Property |
| Tfus | 470.92 | K | Joback Calculated Property |
| Vc | 1.228 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1064.43; 1156.67] | J/mol×K | [868.94; 1069.26] |
|
| Cp,gas | 1064.43 | J/mol×K | 868.94 | Joback Calculated Property |
| Cp,gas | 1083.28 | J/mol×K | 902.33 | Joback Calculated Property |
| Cp,gas | 1100.70 | J/mol×K | 935.71 | Joback Calculated Property |
| Cp,gas | 1116.73 | J/mol×K | 969.10 | Joback Calculated Property |
| Cp,gas | 1131.38 | J/mol×K | 1002.48 | Joback Calculated Property |
| Cp,gas | 1144.69 | J/mol×K | 1035.87 | Joback Calculated Property |
| Cp,gas | 1156.67 | J/mol×K | 1069.26 | Joback Calculated Property |
| η | [0.0000529; 0.0009203] | Pa×s | [470.92; 868.94] |
|
| η | 0.0009203 | Pa×s | 470.92 | Joback Calculated Property |
| η | 0.0004261 | Pa×s | 537.26 | Joback Calculated Property |
| η | 0.0002336 | Pa×s | 603.59 | Joback Calculated Property |
| η | 0.0001443 | Pa×s | 669.93 | Joback Calculated Property |
| η | 0.0000972 | Pa×s | 736.27 | Joback Calculated Property |
| η | 0.0000699 | Pa×s | 802.60 | Joback Calculated Property |
| η | 0.0000529 | Pa×s | 868.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-Cyclohex-4-en-1,2-dicarboxylic acid, isohexyl octyl ester.
Sources
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