- InChI
- InChI=1S/C22H38O4/c1-4-6-7-8-9-10-11-12-13-14-15-19-25-21(23)17-18-22(24)26-20(3)16-5-2/h5,17-18,20H,2,4,6-16,19H2,1,3H3/b18-17+
- InChI Key
- UBCSVUIMOSQVRF-ISLYRVAYSA-N
- Formula
- C22H38O4
- SMILES
-
C=CCC(C)OC(=O)C=CC(=O)OCCCCCCC
CCCCCC - Molecular Weight1
- 366.53
- 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° | -167.86 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -749.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 53.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.78 | kJ/mol | Joback Calculated Property |
| log10WS | -6.58 | Crippen Calculated Property | |
| logPoct/wat | 5.905 | Crippen Calculated Property | |
| McVol | 327.120 | ml/mol | McGowan Calculated Property |
| Pc | 1016.83 | kPa | Joback Calculated Property |
| Inp | [2495.00; 2495.00] |
|
|
| Inp | 2495.00 | NIST | |
| Inp | 2495.00 | NIST | |
| Tboil | 855.74 | K | Joback Calculated Property |
| Tc | 1049.03 | K | Joback Calculated Property |
| Tfus | 460.18 | K | Joback Calculated Property |
| Vc | 1.270 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1038.32; 1130.91] | J/mol×K | [855.74; 1049.03] |
|
| Cp,gas | 1038.32 | J/mol×K | 855.74 | Joback Calculated Property |
| Cp,gas | 1056.35 | J/mol×K | 887.96 | Joback Calculated Property |
| Cp,gas | 1073.29 | J/mol×K | 920.17 | Joback Calculated Property |
| Cp,gas | 1089.18 | J/mol×K | 952.39 | Joback Calculated Property |
| Cp,gas | 1104.05 | J/mol×K | 984.60 | Joback Calculated Property |
| Cp,gas | 1117.95 | J/mol×K | 1016.82 | Joback Calculated Property |
| Cp,gas | 1130.91 | J/mol×K | 1049.03 | Joback Calculated Property |
| η | [0.0000340; 0.0007412] | Pa×s | [460.18; 855.74] |
|
| η | 0.0007412 | Pa×s | 460.18 | Joback Calculated Property |
| η | 0.0003215 | Pa×s | 526.11 | Joback Calculated Property |
| η | 0.0001680 | Pa×s | 592.03 | Joback Calculated Property |
| η | 0.0000999 | Pa×s | 657.96 | Joback Calculated Property |
| η | 0.0000654 | Pa×s | 723.89 | Joback Calculated Property |
| η | 0.0000459 | Pa×s | 789.81 | Joback Calculated Property |
| η | 0.0000340 | Pa×s | 855.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, pent-4-en-2-yl tridecyl ester.
Sources
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