- InChI
- InChI=1S/C23H40O4/c1-3-5-7-9-10-11-12-13-14-15-17-21-27-23(25)19-18-22(24)26-20-16-8-6-4-2/h6,8,18-19H,3-5,7,9-17,20-21H2,1-2H3/b8-6+,19-18+
- InChI Key
- NWYSCFQMVILLBL-OVWOTOAESA-N
- Formula
- C23H40O4
- SMILES
-
CCC=CCCOC(=O)C=CC(=O)OCCCCCCCC
CCCCC - Molecular Weight1
- 380.56
- 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° | -164.62 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -773.21 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.02 | kJ/mol | Joback Calculated Property |
| log10WS | -6.88 | Crippen Calculated Property | |
| logPoct/wat | 6.296 | Crippen Calculated Property | |
| McVol | 341.210 | ml/mol | McGowan Calculated Property |
| Pc | 958.51 | kPa | Joback Calculated Property |
| Inp | 2676.00 | NIST | |
| Tboil | 886.54 | K | Joback Calculated Property |
| Tc | 1085.50 | K | Joback Calculated Property |
| Tfus | 483.13 | K | Joback Calculated Property |
| Vc | 1.331 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1101.05; 1196.35] | J/mol×K | [886.54; 1085.50] | 
|
| Cp,gas | 1101.05 | J/mol×K | 886.54 | Joback Calculated Property |
| Cp,gas | 1119.53 | J/mol×K | 919.70 | Joback Calculated Property |
| Cp,gas | 1136.90 | J/mol×K | 952.86 | Joback Calculated Property |
| Cp,gas | 1153.22 | J/mol×K | 986.02 | Joback Calculated Property |
| Cp,gas | 1168.53 | J/mol×K | 1019.18 | Joback Calculated Property |
| Cp,gas | 1182.89 | J/mol×K | 1052.34 | Joback Calculated Property |
| Cp,gas | 1196.35 | J/mol×K | 1085.50 | Joback Calculated Property |
| η | [0.0000261; 0.0005147] | Pa×s | [483.13; 886.54] |
|
| η | 0.0005147 | Pa×s | 483.13 | Joback Calculated Property |
| η | 0.0002312 | Pa×s | 550.37 | Joback Calculated Property |
| η | 0.0001236 | Pa×s | 617.60 | Joback Calculated Property |
| η | 0.0000747 | Pa×s | 684.84 | Joback Calculated Property |
| η | 0.0000494 | Pa×s | 752.07 | Joback Calculated Property |
| η | 0.0000350 | Pa×s | 819.31 | Joback Calculated Property |
| η | 0.0000261 | Pa×s | 886.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, trans-hex-3-enyl tridecyl ester.
Sources
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