- InChI
- InChI=1S/C20H34O4/c1-4-5-6-7-8-9-10-11-16-23-19(21)14-15-20(22)24-17-12-13-18(2)3/h8-9,14-15,18H,4-7,10-13,16-17H2,1-3H3/b9-8+,15-14+
- InChI Key
- INEJRGMUNCASRS-IDRAWEHWSA-N
- Formula
- C20H34O4
- SMILES
-
CCCCCC=CCCCOC(=O)C=CC(=O)OCCCC
(C)C - Molecular Weight1
- 338.48
- 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° | -192.32 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -716.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 50.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.95 | kJ/mol | Joback Calculated Property |
| log10WS | -5.39 | Crippen Calculated Property | |
| logPoct/wat | 4.982 | Crippen Calculated Property | |
| McVol | 298.940 | ml/mol | McGowan Calculated Property |
| Pc | 1161.66 | kPa | Joback Calculated Property |
| Inp | [2327.00; 2327.00] |
|
|
| Inp | 2327.00 | NIST | |
| Inp | 2327.00 | NIST | |
| Tboil | 817.46 | K | Joback Calculated Property |
| Tc | 1007.48 | K | Joback Calculated Property |
| Tfus | 434.32 | K | Joback Calculated Property |
| Vc | 1.157 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [918.85; 1008.50] | J/mol×K | [817.46; 1007.48] |
|
| Cp,gas | 918.85 | J/mol×K | 817.46 | Joback Calculated Property |
| Cp,gas | 936.09 | J/mol×K | 849.13 | Joback Calculated Property |
| Cp,gas | 952.36 | J/mol×K | 880.80 | Joback Calculated Property |
| Cp,gas | 967.70 | J/mol×K | 912.47 | Joback Calculated Property |
| Cp,gas | 982.15 | J/mol×K | 944.14 | Joback Calculated Property |
| Cp,gas | 995.74 | J/mol×K | 975.81 | Joback Calculated Property |
| Cp,gas | 1008.50 | J/mol×K | 1007.48 | Joback Calculated Property |
| η | [0.0000370; 0.0008646] | Pa×s | [434.32; 817.46] |
|
| η | 0.0008646 | Pa×s | 434.32 | Joback Calculated Property |
| η | 0.0003652 | Pa×s | 498.18 | Joback Calculated Property |
| η | 0.0001876 | Pa×s | 562.03 | Joback Calculated Property |
| η | 0.0001104 | Pa×s | 625.89 | Joback Calculated Property |
| η | 0.0000717 | Pa×s | 689.75 | Joback Calculated Property |
| η | 0.0000501 | Pa×s | 753.60 | Joback Calculated Property |
| η | 0.0000370 | Pa×s | 817.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, dec-4-enyl isohexyl ester.
Sources
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