- InChI
- InChI=1S/C28H52O4/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-22-26-32-28(30)24-20-19-23-27(29)31-25-21-8-6-4-2/h6,8H,3-5,7,9-26H2,1-2H3/b8-6+
- InChI Key
- VFOCHYXWAFNOGA-SOFGYWHQSA-N
- Formula
- C28H52O4
- SMILES
-
CCC=CCCOC(=O)CCCCC(=O)OCCCCCCC
CCCCCCCCC - Molecular Weight1
- 452.71
- 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° | -202.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -993.63 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 74.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.19 | kJ/mol | Joback Calculated Property |
| log10WS | -9.12 | Crippen Calculated Property | |
| logPoct/wat | 8.471 | Crippen Calculated Property | |
| McVol | 415.960 | ml/mol | McGowan Calculated Property |
| Pc | 706.58 | kPa | Joback Calculated Property |
| Inp | [3131.00; 3131.00] |
|
|
| Inp | 3131.00 | NIST | |
| Inp | 3131.00 | NIST | |
| Tboil | 996.78 | K | Joback Calculated Property |
| Tc | 1234.53 | K | Joback Calculated Property |
| Tfus | 544.56 | K | Joback Calculated Property |
| Vc | 1.631 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1446.46; 1554.32] | J/mol×K | [996.78; 1234.53] |
|
| Cp,gas | 1446.46 | J/mol×K | 996.78 | Joback Calculated Property |
| Cp,gas | 1468.63 | J/mol×K | 1036.40 | Joback Calculated Property |
| Cp,gas | 1489.00 | J/mol×K | 1076.03 | Joback Calculated Property |
| Cp,gas | 1507.66 | J/mol×K | 1115.65 | Joback Calculated Property |
| Cp,gas | 1524.71 | J/mol×K | 1155.28 | Joback Calculated Property |
| Cp,gas | 1540.23 | J/mol×K | 1194.90 | Joback Calculated Property |
| Cp,gas | 1554.32 | J/mol×K | 1234.53 | Joback Calculated Property |
| η | [0.0000139; 0.0002922] | Pa×s | [544.56; 996.78] |
|
| η | 0.0002922 | Pa×s | 544.56 | Joback Calculated Property |
| η | 0.0001291 | Pa×s | 619.93 | Joback Calculated Property |
| η | 0.0000681 | Pa×s | 695.30 | Joback Calculated Property |
| η | 0.0000407 | Pa×s | 770.67 | Joback Calculated Property |
| η | 0.0000266 | Pa×s | 846.04 | Joback Calculated Property |
| η | 0.0000187 | Pa×s | 921.41 | Joback Calculated Property |
| η | 0.0000139 | Pa×s | 996.78 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, hexadecyl trans-hex-3-enyl ester.
Sources
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