- InChI
- InChI=1S/C16H26O4/c1-3-5-6-7-8-9-10-14-20-16(18)12-11-15(17)19-13-4-2/h8-9,11-12H,3-7,10,13-14H2,1-2H3/b9-8-,12-11+
- InChI Key
- CGTOJJPEEONSGI-UONSLQGUSA-N
- Formula
- C16H26O4
- SMILES
- CCCCCC=CCCOC(=O)C=CC(=O)OCCC
- Molecular Weight1
- 282.38
- 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° | -223.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -628.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.44 | kJ/mol | Joback Calculated Property |
| log10WS | -3.95 | Crippen Calculated Property | |
| logPoct/wat | 3.566 | Crippen Calculated Property | |
| McVol | 242.580 | ml/mol | McGowan Calculated Property |
| Pc | 1528.27 | kPa | Joback Calculated Property |
| Inp | [1970.00; 1970.00] |
|
|
| Inp | 1970.00 | NIST | |
| Inp | 1970.00 | NIST | |
| Tboil | 726.38 | K | Joback Calculated Property |
| Tc | 911.77 | K | Joback Calculated Property |
| Tfus | 404.24 | K | Joback Calculated Property |
| Vc | 0.940 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [686.97; 768.68] | J/mol×K | [726.38; 911.77] |
|
| Cp,gas | 686.97 | J/mol×K | 726.38 | Joback Calculated Property |
| Cp,gas | 702.52 | J/mol×K | 757.28 | Joback Calculated Property |
| Cp,gas | 717.26 | J/mol×K | 788.18 | Joback Calculated Property |
| Cp,gas | 731.22 | J/mol×K | 819.07 | Joback Calculated Property |
| Cp,gas | 744.43 | J/mol×K | 849.97 | Joback Calculated Property |
| Cp,gas | 756.90 | J/mol×K | 880.87 | Joback Calculated Property |
| Cp,gas | 768.68 | J/mol×K | 911.77 | Joback Calculated Property |
| η | [0.0000692; 0.0010816] | Pa×s | [404.24; 726.38] |
|
| η | 0.0010816 | Pa×s | 404.24 | Joback Calculated Property |
| η | 0.0005229 | Pa×s | 457.93 | Joback Calculated Property |
| η | 0.0002944 | Pa×s | 511.62 | Joback Calculated Property |
| η | 0.0001849 | Pa×s | 565.31 | Joback Calculated Property |
| η | 0.0001259 | Pa×s | 619.00 | Joback Calculated Property |
| η | 0.0000911 | Pa×s | 672.69 | Joback Calculated Property |
| η | 0.0000692 | Pa×s | 726.38 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, cis-non-3-enyl propyl ester.
Sources
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