- InChI
- InChI=1S/C23H40O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-20-26-22(24)18-19-23(25)27-21(3)17-5-2/h5,18-19,21H,2,4,6-17,20H2,1,3H3/b19-18+
- InChI Key
- VCUQKMACEJNVBR-VHEBQXMUSA-N
- Formula
- C23H40O4
- SMILES
-
C=CCC(C)OC(=O)C=CC(=O)OCCCCCCC
CCCCCCC - Molecular Weight1
- 380.56
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.0479 | Relay (1.0) Calculated Property | |
| ΔfG° | -159.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -954.88 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 56.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 110.16 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.86 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.61 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.295 | Crippen Calculated Property | |
| McVol | 341.210 | ml/mol | McGowan Calculated Property |
| Pc | 957.32 | kPa | Joback Calculated Property |
| Inp | [2595.00; 2595.00] |
|
|
| Inp | 2595.00 | NIST | |
| Inp | 2595.00 | NIST | |
| Tboil | 637.94 | K | Relay (1.0) Calculated Property |
| Tc | 801.08 | K | Relay (1.0) Calculated Property |
| Tfus | 281.16 | K | Relay (1.0) Calculated Property |
| Vc | 1.258 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1099.87; 1194.18] | J/mol×K | [878.62; 1075.92] |
|
| Cp,gas | 1099.87 | J/mol×K | 878.62 | Joback Calculated Property |
| Cp,gas | 1118.33 | J/mol×K | 911.50 | Joback Calculated Property |
| Cp,gas | 1135.64 | J/mol×K | 944.39 | Joback Calculated Property |
| Cp,gas | 1151.84 | J/mol×K | 977.27 | Joback Calculated Property |
| Cp,gas | 1166.96 | J/mol×K | 1010.16 | Joback Calculated Property |
| Cp,gas | 1181.07 | J/mol×K | 1043.04 | Joback Calculated Property |
| Cp,gas | 1194.18 | J/mol×K | 1075.92 | Joback Calculated Property |
| η | [0.0000294; 0.0006567] | Pa×s | [471.45; 878.62] |
|
| η | 0.0006567 | Pa×s | 471.45 | Joback Calculated Property |
| η | 0.0002824 | Pa×s | 539.31 | Joback Calculated Property |
| η | 0.0001467 | Pa×s | 607.17 | Joback Calculated Property |
| η | 0.0000869 | Pa×s | 675.03 | Joback Calculated Property |
| η | 0.0000567 | Pa×s | 742.90 | Joback Calculated Property |
| η | 0.0000397 | Pa×s | 810.76 | Joback Calculated Property |
| η | 0.0000294 | Pa×s | 878.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, pent-4-en-2-yl tetradecyl ester.
Sources
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