- InChI
- InChI=1S/C33H62O4/c1-4-6-8-10-12-13-14-15-16-17-18-19-20-21-22-24-26-30-36-32(34)28-29-33(35)37-31(3)27-25-23-11-9-7-5-2/h28-29,31H,4-27,30H2,1-3H3/b29-28+
- InChI Key
- DCRUNYSYJXFGGA-ZQHSETAFSA-N
- Formula
- C33H62O4
- SMILES
-
CCCCCCCCCCCCCCCCCCCOC(=O)C=CC(
=O)OC(C)CCCCCCCC - Molecular Weight1
- 522.84
- 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° | -163.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1102.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 83.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.93 | kJ/mol | Joback Calculated Property |
| log10WS | -11.33 | Crippen Calculated Property | |
| logPoct/wat | 10.420 | Crippen Calculated Property | |
| McVol | 486.410 | ml/mol | McGowan Calculated Property |
| Pc | 557.83 | kPa | Joback Calculated Property |
| Inp | [3606.00; 3606.00] |
|
|
| Inp | 3606.00 | NIST | |
| Inp | 3606.00 | NIST | |
| Tboil | 1110.74 | K | Joback Calculated Property |
| Tc | 1418.73 | K | Joback Calculated Property |
| Tfus | 585.91 | K | Joback Calculated Property |
| Vc | 1.905 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1774.71; 1894.19] | J/mol×K | [1110.74; 1418.73] |
|
| Cp,gas | 1774.71 | J/mol×K | 1110.74 | Joback Calculated Property |
| Cp,gas | 1801.07 | J/mol×K | 1162.07 | Joback Calculated Property |
| Cp,gas | 1824.52 | J/mol×K | 1213.40 | Joback Calculated Property |
| Cp,gas | 1845.31 | J/mol×K | 1264.73 | Joback Calculated Property |
| Cp,gas | 1863.69 | J/mol×K | 1316.06 | Joback Calculated Property |
| Cp,gas | 1879.90 | J/mol×K | 1367.40 | Joback Calculated Property |
| Cp,gas | 1894.19 | J/mol×K | 1418.73 | Joback Calculated Property |
| η | [0.0000056; 0.0001618] | Pa×s | [585.91; 1110.74] |
|
| η | 0.0001618 | Pa×s | 585.91 | Joback Calculated Property |
| η | 0.0000642 | Pa×s | 673.38 | Joback Calculated Property |
| η | 0.0000315 | Pa×s | 760.85 | Joback Calculated Property |
| η | 0.0000179 | Pa×s | 848.33 | Joback Calculated Property |
| η | 0.0000113 | Pa×s | 935.80 | Joback Calculated Property |
| η | 0.0000077 | Pa×s | 1023.27 | Joback Calculated Property |
| η | 0.0000056 | Pa×s | 1110.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2-decyl nonadecyl ester.
Sources
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