- InChI
- InChI=1S/C27H50O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-20-24-30-26(28)22-18-19-23-27(29)31-25(3)21-5-2/h5,25H,2,4,6-24H2,1,3H3
- InChI Key
- IRYCIXGKQUXYAI-UHFFFAOYSA-N
- Formula
- C27H50O4
- SMILES
-
C=CCC(C)OC(=O)CCCCC(=O)OCCCCCC
CCCCCCCCCC - Molecular Weight1
- 438.68
- 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° | -205.98 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -970.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 66.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.95 | kJ/mol | Joback Calculated Property |
| log10WS | -8.82 | Crippen Calculated Property | |
| logPoct/wat | 8.079 | Crippen Calculated Property | |
| McVol | 401.870 | ml/mol | McGowan Calculated Property |
| Pc | 743.26 | kPa | Joback Calculated Property |
| Inp | 2949.00 | NIST | |
| Tboil | 965.98 | K | Joback Calculated Property |
| Tc | 1190.59 | K | Joback Calculated Property |
| Tfus | 521.61 | K | Joback Calculated Property |
| Vc | 1.571 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1380.03; 1482.67] | J/mol×K | [965.98; 1190.59] | 
|
| Cp,gas | 1380.03 | J/mol×K | 965.98 | Joback Calculated Property |
| Cp,gas | 1401.21 | J/mol×K | 1003.42 | Joback Calculated Property |
| Cp,gas | 1420.68 | J/mol×K | 1040.85 | Joback Calculated Property |
| Cp,gas | 1438.50 | J/mol×K | 1078.29 | Joback Calculated Property |
| Cp,gas | 1454.73 | J/mol×K | 1115.72 | Joback Calculated Property |
| Cp,gas | 1469.43 | J/mol×K | 1153.16 | Joback Calculated Property |
| Cp,gas | 1482.67 | J/mol×K | 1190.59 | Joback Calculated Property |
| η | [0.0000182; 0.0004208] | Pa×s | [521.61; 965.98] |
|
| η | 0.0004208 | Pa×s | 521.61 | Joback Calculated Property |
| η | 0.0001800 | Pa×s | 595.67 | Joback Calculated Property |
| η | 0.0000929 | Pa×s | 669.73 | Joback Calculated Property |
| η | 0.0000547 | Pa×s | 743.80 | Joback Calculated Property |
| η | 0.0000355 | Pa×s | 817.86 | Joback Calculated Property |
| η | 0.0000247 | Pa×s | 891.92 | Joback Calculated Property |
| η | 0.0000182 | Pa×s | 965.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, hexadecyl pent-4-en-2-yl ester.
Sources
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