- InChI
- InChI=1S/C29H52O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-25-33-29(31)27-23-20-19-22-26(27)28(30)32-24-4-2/h4,26-27H,2-3,5-25H2,1H3
- InChI Key
- HEFFSOHYOKUWFM-UHFFFAOYSA-N
- Formula
- C29H52O4
- SMILES
-
C=CCOC(=O)C1CCCCC1C(=O)OCCCCCC
CCCCCCCCCCCC - Molecular Weight1
- 464.72
- 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° | -169.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -972.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 68.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 97.91 | kJ/mol | Joback Calculated Property |
| log10WS | -8.95 | Crippen Calculated Property | |
| logPoct/wat | 8.327 | Crippen Calculated Property | |
| McVol | 419.190 | ml/mol | McGowan Calculated Property |
| Pc | 732.04 | kPa | Joback Calculated Property |
| Inp | [3296.00; 3296.00] |
|
|
| Inp | 3296.00 | NIST | |
| Inp | 3296.00 | NIST | |
| Tboil | 1027.06 | K | Joback Calculated Property |
| Tc | 1265.00 | K | Joback Calculated Property |
| Tfus | 562.29 | K | Joback Calculated Property |
| Vc | 1.621 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1508.93; 1600.47] | J/mol×K | [1027.06; 1265.00] |
|
| Cp,gas | 1508.93 | J/mol×K | 1027.06 | Joback Calculated Property |
| Cp,gas | 1529.33 | J/mol×K | 1066.72 | Joback Calculated Property |
| Cp,gas | 1547.57 | J/mol×K | 1106.37 | Joback Calculated Property |
| Cp,gas | 1563.73 | J/mol×K | 1146.03 | Joback Calculated Property |
| Cp,gas | 1577.88 | J/mol×K | 1185.69 | Joback Calculated Property |
| Cp,gas | 1590.10 | J/mol×K | 1225.34 | Joback Calculated Property |
| Cp,gas | 1600.47 | J/mol×K | 1265.00 | Joback Calculated Property |
| η | [0.0000202; 0.0003628] | Pa×s | [562.29; 1027.06] |
|
| η | 0.0003628 | Pa×s | 562.29 | Joback Calculated Property |
| η | 0.0001675 | Pa×s | 639.75 | Joback Calculated Property |
| η | 0.0000914 | Pa×s | 717.21 | Joback Calculated Property |
| η | 0.0000561 | Pa×s | 794.67 | Joback Calculated Property |
| η | 0.0000376 | Pa×s | 872.14 | Joback Calculated Property |
| η | 0.0000269 | Pa×s | 949.60 | Joback Calculated Property |
| η | 0.0000202 | Pa×s | 1027.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, allyl octadecyl ester.
Sources
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