- InChI
- InChI=1S/C16H26O4/c1-3-5-7-8-10-14-20-16(18)12-11-15(17)19-13-9-6-4-2/h4,11-12H,2-3,5-10,13-14H2,1H3/b12-11+
- InChI Key
- SGLOUBOOSRWDAJ-VAWYXSNFSA-N
- Formula
- C16H26O4
- SMILES
- C=CCCCOC(=O)C=CC(=O)OCCCCCCC
- 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° | -215.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -620.52 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.81 | 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 | 1516.39 | kPa | Joback Calculated Property |
| Inp | [1988.00; 1988.00] |
|
|
| Inp | 1988.00 | NIST | |
| Inp | 1988.00 | NIST | |
| Tboil | 718.90 | K | Joback Calculated Property |
| Tc | 901.36 | K | Joback Calculated Property |
| Tfus | 407.56 | K | Joback Calculated Property |
| Vc | 0.941 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [685.83; 767.42] | J/mol×K | [718.90; 901.36] |
|
| Cp,gas | 685.83 | J/mol×K | 718.90 | Joback Calculated Property |
| Cp,gas | 701.37 | J/mol×K | 749.31 | Joback Calculated Property |
| Cp,gas | 716.10 | J/mol×K | 779.72 | Joback Calculated Property |
| Cp,gas | 730.05 | J/mol×K | 810.13 | Joback Calculated Property |
| Cp,gas | 743.24 | J/mol×K | 840.54 | Joback Calculated Property |
| Cp,gas | 755.69 | J/mol×K | 870.95 | Joback Calculated Property |
| Cp,gas | 767.42 | J/mol×K | 901.36 | Joback Calculated Property |
| η | [0.0000846; 0.0011610] | Pa×s | [407.56; 718.90] |
|
| η | 0.0011610 | Pa×s | 407.56 | Joback Calculated Property |
| η | 0.0005865 | Pa×s | 459.45 | Joback Calculated Property |
| η | 0.0003403 | Pa×s | 511.34 | Joback Calculated Property |
| η | 0.0002183 | Pa×s | 563.23 | Joback Calculated Property |
| η | 0.0001509 | Pa×s | 615.12 | Joback Calculated Property |
| η | 0.0001105 | Pa×s | 667.01 | Joback Calculated Property |
| η | 0.0000846 | Pa×s | 718.90 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, heptyl pent-4-enyl ester.
Sources
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