- InChI
- InChI=1S/C30H56O4/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-33-28(31)24-25-29(32)34-27(2)30(3,4)5/h24-25,27H,6-23,26H2,1-5H3/b25-24+
- InChI Key
- UWPSFUHXYRHLOJ-OCOZRVBESA-N
- Formula
- C30H56O4
- SMILES
-
CCCCCCCCCCCCCCCCCCCCOC(=O)C=CC
(=O)OC(C)C(C)(C)C - Molecular Weight1
- 480.76
- 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° | -185.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1048.94 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 68.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.96 | kJ/mol | Joback Calculated Property |
| log10WS | -9.83 | Crippen Calculated Property | |
| logPoct/wat | 9.105 | Crippen Calculated Property | |
| McVol | 444.140 | ml/mol | McGowan Calculated Property |
| Pc | 648.45 | kPa | Joback Calculated Property |
| Inp | [3247.00; 3247.00] |
|
|
| Inp | 3247.00 | NIST | |
| Inp | 3247.00 | NIST | |
| Tboil | 1038.87 | K | Joback Calculated Property |
| Tc | 1289.47 | K | Joback Calculated Property |
| Tfus | 554.52 | K | Joback Calculated Property |
| Vc | 1.726 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1576.69; 1690.79] | J/mol×K | [1038.87; 1289.47] |
|
| Cp,gas | 1576.69 | J/mol×K | 1038.87 | Joback Calculated Property |
| Cp,gas | 1599.71 | J/mol×K | 1080.64 | Joback Calculated Property |
| Cp,gas | 1620.93 | J/mol×K | 1122.40 | Joback Calculated Property |
| Cp,gas | 1640.51 | J/mol×K | 1164.17 | Joback Calculated Property |
| Cp,gas | 1658.58 | J/mol×K | 1205.94 | Joback Calculated Property |
| Cp,gas | 1675.29 | J/mol×K | 1247.71 | Joback Calculated Property |
| Cp,gas | 1690.79 | J/mol×K | 1289.47 | Joback Calculated Property |
| η | [0.0000068; 0.0002197] | Pa×s | [554.52; 1038.87] |
|
| η | 0.0002197 | Pa×s | 554.52 | Joback Calculated Property |
| η | 0.0000853 | Pa×s | 635.25 | Joback Calculated Property |
| η | 0.0000410 | Pa×s | 715.97 | Joback Calculated Property |
| η | 0.0000229 | Pa×s | 796.69 | Joback Calculated Property |
| η | 0.0000142 | Pa×s | 877.42 | Joback Calculated Property |
| η | 0.0000096 | Pa×s | 958.14 | Joback Calculated Property |
| η | 0.0000068 | Pa×s | 1038.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 3,3-dimethylbut-2-yl eicosyl ester.
Sources
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