- InChI
- InChI=1S/C13H20O4/c1-3-5-7-11-17-13(15)9-8-12(14)16-10-6-4-2/h3,8-9H,1,4-7,10-11H2,2H3/b9-8+
- InChI Key
- UPWPLXAPKLFNSX-CMDGGOBGSA-N
- Formula
- C13H20O4
- SMILES
- C=CCCCOC(=O)C=CC(=O)OCCCC
- Molecular Weight1
- 240.30
- 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° | -241.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -558.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.13 | kJ/mol | Joback Calculated Property |
| log10WS | -2.70 | Crippen Calculated Property | |
| logPoct/wat | 2.395 | Crippen Calculated Property | |
| McVol | 200.310 | ml/mol | McGowan Calculated Property |
| Pc | 1923.67 | kPa | Joback Calculated Property |
| Inp | 1679.00 | NIST | |
| Tboil | 650.26 | K | Joback Calculated Property |
| Tc | 835.14 | K | Joback Calculated Property |
| Tfus | 373.75 | K | Joback Calculated Property |
| Vc | 0.772 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [524.33; 598.69] | J/mol×K | [650.26; 835.14] | 
|
| Cp,gas | 524.33 | J/mol×K | 650.26 | Joback Calculated Property |
| Cp,gas | 538.41 | J/mol×K | 681.07 | Joback Calculated Property |
| Cp,gas | 551.80 | J/mol×K | 711.89 | Joback Calculated Property |
| Cp,gas | 564.51 | J/mol×K | 742.70 | Joback Calculated Property |
| Cp,gas | 576.55 | J/mol×K | 773.51 | Joback Calculated Property |
| Cp,gas | 587.94 | J/mol×K | 804.33 | Joback Calculated Property |
| Cp,gas | 598.69 | J/mol×K | 835.14 | Joback Calculated Property |
| η | [0.0001217; 0.0014567] | Pa×s | [373.75; 650.26] |
|
| η | 0.0014567 | Pa×s | 373.75 | Joback Calculated Property |
| η | 0.0007674 | Pa×s | 419.83 | Joback Calculated Property |
| η | 0.0004590 | Pa×s | 465.92 | Joback Calculated Property |
| η | 0.0003011 | Pa×s | 512.00 | Joback Calculated Property |
| η | 0.0002118 | Pa×s | 558.09 | Joback Calculated Property |
| η | 0.0001571 | Pa×s | 604.17 | Joback Calculated Property |
| η | 0.0001217 | Pa×s | 650.26 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, butyl pent-4-enyl ester.
Sources
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