- InChI
- InChI=1S/C30H56O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-33-29(31)24-25-30(32)34-27-28(3)23-5-2/h24-25,28H,4-23,26-27H2,1-3H3/b25-24+
- InChI Key
- ZIXMAAYGENNJQA-OCOZRVBESA-N
- Formula
- C30H56O4
- SMILES
-
CCCCCCCCCCCCCCCCCCCCOC(=O)C=CC
(=O)OCC(C)CCC - 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° | -188.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1040.19 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 75.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.26 | kJ/mol | Joback Calculated Property |
| log10WS | -9.72 | Crippen Calculated Property | |
| logPoct/wat | 9.107 | Crippen Calculated Property | |
| McVol | 444.140 | ml/mol | McGowan Calculated Property |
| Pc | 642.22 | kPa | Joback Calculated Property |
| Inp | [3284.00; 3284.00] |
|
|
| Inp | 3284.00 | NIST | |
| Inp | 3284.00 | NIST | |
| Tboil | 1042.10 | K | Joback Calculated Property |
| Tc | 1301.69 | K | Joback Calculated Property |
| Tfus | 552.10 | K | Joback Calculated Property |
| Vc | 1.738 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1577.07; 1688.31] | J/mol×K | [1042.10; 1301.69] |
|
| Cp,gas | 1577.07 | J/mol×K | 1042.10 | Joback Calculated Property |
| Cp,gas | 1600.54 | J/mol×K | 1085.36 | Joback Calculated Property |
| Cp,gas | 1621.87 | J/mol×K | 1128.63 | Joback Calculated Property |
| Cp,gas | 1641.18 | J/mol×K | 1171.89 | Joback Calculated Property |
| Cp,gas | 1658.60 | J/mol×K | 1215.16 | Joback Calculated Property |
| Cp,gas | 1674.27 | J/mol×K | 1258.42 | Joback Calculated Property |
| Cp,gas | 1688.31 | J/mol×K | 1301.69 | Joback Calculated Property |
| η | [0.0000092; 0.0002504] | Pa×s | [552.10; 1042.10] |
|
| η | 0.0002504 | Pa×s | 552.10 | Joback Calculated Property |
| η | 0.0001011 | Pa×s | 633.77 | Joback Calculated Property |
| η | 0.0000502 | Pa×s | 715.43 | Joback Calculated Property |
| η | 0.0000288 | Pa×s | 797.10 | Joback Calculated Property |
| η | 0.0000183 | Pa×s | 878.77 | Joback Calculated Property |
| η | 0.0000126 | Pa×s | 960.43 | Joback Calculated Property |
| η | 0.0000092 | Pa×s | 1042.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, eicosyl 2-methylpentyl ester.
Sources
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