- InChI
- InChI=1S/C27H48O4/c1-4-7-9-10-11-12-13-14-17-21-30-26(28)24-19-15-16-20-25(24)27(29)31-22-23(6-3)18-8-5-2/h15-16,23-25H,4-14,17-22H2,1-3H3
- InChI Key
- SZXMWPGWPHRIKW-UHFFFAOYSA-N
- Formula
- C27H48O4
- SMILES
-
CCCCCCCCCCCOC(=O)C1CC=CCC1C(=O
)OCC(CC)CCCC - Molecular Weight1
- 436.67
- 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° | -247.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1003.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.03 | kJ/mol | Joback Calculated Property |
| log10WS | -7.87 | Crippen Calculated Property | |
| logPoct/wat | 7.402 | Crippen Calculated Property | |
| McVol | 391.010 | ml/mol | McGowan Calculated Property |
| Pc | 815.39 | kPa | Joback Calculated Property |
| Inp | [2887.00; 2887.00] |
|
|
| Inp | 2887.00 | NIST | |
| Inp | 2887.00 | NIST | |
| Tboil | 983.34 | K | Joback Calculated Property |
| Tc | 1205.22 | K | Joback Calculated Property |
| Tfus | 527.27 | K | Joback Calculated Property |
| Vc | 1.508 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1379.25; 1469.30] | J/mol×K | [983.34; 1205.22] |
|
| Cp,gas | 1379.25 | J/mol×K | 983.34 | Joback Calculated Property |
| Cp,gas | 1398.80 | J/mol×K | 1020.32 | Joback Calculated Property |
| Cp,gas | 1416.47 | J/mol×K | 1057.30 | Joback Calculated Property |
| Cp,gas | 1432.30 | J/mol×K | 1094.28 | Joback Calculated Property |
| Cp,gas | 1446.35 | J/mol×K | 1131.26 | Joback Calculated Property |
| Cp,gas | 1458.67 | J/mol×K | 1168.24 | Joback Calculated Property |
| Cp,gas | 1469.30 | J/mol×K | 1205.22 | Joback Calculated Property |
| η | [0.0000254; 0.0005083] | Pa×s | [527.27; 983.34] |
|
| η | 0.0005083 | Pa×s | 527.27 | Joback Calculated Property |
| η | 0.0002251 | Pa×s | 603.28 | Joback Calculated Property |
| η | 0.0001197 | Pa×s | 679.29 | Joback Calculated Property |
| η | 0.0000722 | Pa×s | 755.31 | Joback Calculated Property |
| η | 0.0000478 | Pa×s | 831.32 | Joback Calculated Property |
| η | 0.0000339 | Pa×s | 907.33 | Joback Calculated Property |
| η | 0.0000254 | Pa×s | 983.34 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-Cyclohex-4-en-1,2-dicarboxylic acid, 2-ethylhexyl undecyl ester.
Sources
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