- InChI
- InChI=1S/C25H36O4/c1-2-3-4-5-6-7-8-9-10-14-21-28-24(26)19-20-25(27)29-22-15-18-23-16-12-11-13-17-23/h10-14,16-17,19-20H,2-9,15,18,21-22H2,1H3/b14-10+,20-19+
- InChI Key
- MHYIYWBULBBIGN-PVLGCOFDSA-N
- Formula
- C25H36O4
- SMILES
-
CCCCCCCCCC=CCOC(=O)C=CC(=O)OCC
Cc1ccccc1 - Molecular Weight1
- 400.55
- 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° | -35.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -577.96 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 60.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 91.75 | kJ/mol | Joback Calculated Property |
| log10WS | -6.82 | Crippen Calculated Property | |
| logPoct/wat | 5.959 | Crippen Calculated Property | |
| McVol | 345.630 | ml/mol | McGowan Calculated Property |
| Pc | 1046.65 | kPa | Joback Calculated Property |
| Inp | [3016.00; 3016.00] |
|
|
| Inp | 3016.00 | NIST | |
| Inp | 3016.00 | NIST | |
| Tboil | 958.98 | K | Joback Calculated Property |
| Tc | 1174.97 | K | Joback Calculated Property |
| Tfus | 532.09 | K | Joback Calculated Property |
| Vc | 1.335 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1125.52; 1210.04] | J/mol×K | [958.98; 1174.97] |
|
| Cp,gas | 1125.52 | J/mol×K | 958.98 | Joback Calculated Property |
| Cp,gas | 1142.22 | J/mol×K | 994.98 | Joback Calculated Property |
| Cp,gas | 1157.76 | J/mol×K | 1030.98 | Joback Calculated Property |
| Cp,gas | 1172.24 | J/mol×K | 1066.97 | Joback Calculated Property |
| Cp,gas | 1185.73 | J/mol×K | 1102.97 | Joback Calculated Property |
| Cp,gas | 1198.30 | J/mol×K | 1138.97 | Joback Calculated Property |
| Cp,gas | 1210.04 | J/mol×K | 1174.97 | Joback Calculated Property |
| η | [0.0000199; 0.0003392] | Pa×s | [532.09; 958.98] |
|
| η | 0.0003392 | Pa×s | 532.09 | Joback Calculated Property |
| η | 0.0001601 | Pa×s | 603.24 | Joback Calculated Property |
| η | 0.0000885 | Pa×s | 674.39 | Joback Calculated Property |
| η | 0.0000548 | Pa×s | 745.54 | Joback Calculated Property |
| η | 0.0000369 | Pa×s | 816.68 | Joback Calculated Property |
| η | 0.0000265 | Pa×s | 887.83 | Joback Calculated Property |
| η | 0.0000199 | Pa×s | 958.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 3-phenylpropyl dodec-2-en-1-yl ester.
Sources
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