- InChI
- InChI=1S/C23H40O4/c1-3-5-6-7-8-9-10-11-12-15-19-27-23(25)21-17-14-13-16-20(21)22(24)26-18-4-2/h4,20-21H,2-3,5-19H2,1H3
- InChI Key
- WIGNXGQJIPTUFK-UHFFFAOYSA-N
- Formula
- C23H40O4
- SMILES
-
C=CCOC(=O)C1CCCCC1C(=O)OCCCCCC
CCCCCC - Molecular Weight1
- 380.56
- 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° | -220.48 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -848.24 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 52.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.55 | kJ/mol | Joback Calculated Property |
| log10WS | -6.44 | Crippen Calculated Property | |
| logPoct/wat | 5.986 | Crippen Calculated Property | |
| McVol | 334.650 | ml/mol | McGowan Calculated Property |
| Pc | 1027.28 | kPa | Joback Calculated Property |
| Inp | [2653.00; 2653.00] |
|
|
| Inp | 2653.00 | NIST | |
| Inp | 2653.00 | NIST | |
| Tboil | 889.78 | K | Joback Calculated Property |
| Tc | 1091.86 | K | Joback Calculated Property |
| Tfus | 494.67 | K | Joback Calculated Property |
| Vc | 1.284 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1126.94; 1220.42] | J/mol×K | [889.78; 1091.86] |
|
| Cp,gas | 1126.94 | J/mol×K | 889.78 | Joback Calculated Property |
| Cp,gas | 1146.08 | J/mol×K | 923.46 | Joback Calculated Property |
| Cp,gas | 1163.76 | J/mol×K | 957.14 | Joback Calculated Property |
| Cp,gas | 1180.00 | J/mol×K | 990.82 | Joback Calculated Property |
| Cp,gas | 1194.84 | J/mol×K | 1024.50 | Joback Calculated Property |
| Cp,gas | 1208.30 | J/mol×K | 1058.18 | Joback Calculated Property |
| Cp,gas | 1220.42 | J/mol×K | 1091.86 | Joback Calculated Property |
| η | [0.0000496; 0.0007489] | Pa×s | [494.67; 889.78] |
|
| η | 0.0007489 | Pa×s | 494.67 | Joback Calculated Property |
| η | 0.0003652 | Pa×s | 560.52 | Joback Calculated Property |
| η | 0.0002071 | Pa×s | 626.37 | Joback Calculated Property |
| η | 0.0001308 | Pa×s | 692.23 | Joback Calculated Property |
| η | 0.0000895 | Pa×s | 758.08 | Joback Calculated Property |
| η | 0.0000651 | Pa×s | 823.93 | Joback Calculated Property |
| η | 0.0000496 | Pa×s | 889.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, allyl dodecyl ester.
Sources
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