- InChI
- InChI=1S/C18H32O4/c1-6-7-8-9-10-13-21-16(19)11-12-17(20)22-18(14(2)3)15(4)5/h11-12,14-15,18H,6-10,13H2,1-5H3/b12-11+
- InChI Key
- JZVYNTPHDBNLOR-VAWYXSNFSA-N
- Formula
- C18H32O4
- SMILES
-
CCCCCCCOC(=O)C=CC(=O)OC(C(C)C)
C(C)C - Molecular Weight1
- 312.44
- 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° | -294.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -803.07 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.58 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.77 | kJ/mol | Joback Calculated Property |
| log10WS | -4.56 | Crippen Calculated Property | |
| logPoct/wat | 4.280 | Crippen Calculated Property | |
| McVol | 275.060 | ml/mol | McGowan Calculated Property |
| Pc | 1295.79 | kPa | Joback Calculated Property |
| Inp | 2024.00 | NIST | |
| Tboil | 766.66 | K | Joback Calculated Property |
| Tc | 953.78 | K | Joback Calculated Property |
| Tfus | 386.86 | K | Joback Calculated Property |
| Vc | 1.054 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [826.70; 916.75] | J/mol×K | [766.66; 953.78] | 
|
| Cp,gas | 826.70 | J/mol×K | 766.66 | Joback Calculated Property |
| Cp,gas | 844.06 | J/mol×K | 797.85 | Joback Calculated Property |
| Cp,gas | 860.45 | J/mol×K | 829.03 | Joback Calculated Property |
| Cp,gas | 875.90 | J/mol×K | 860.22 | Joback Calculated Property |
| Cp,gas | 890.41 | J/mol×K | 891.41 | Joback Calculated Property |
| Cp,gas | 904.02 | J/mol×K | 922.60 | Joback Calculated Property |
| Cp,gas | 916.75 | J/mol×K | 953.78 | Joback Calculated Property |
| η | [0.0000478; 0.0017961] | Pa×s | [386.86; 766.66] |
|
| η | 0.0017961 | Pa×s | 386.86 | Joback Calculated Property |
| η | 0.0006417 | Pa×s | 450.16 | Joback Calculated Property |
| η | 0.0002955 | Pa×s | 513.46 | Joback Calculated Property |
| η | 0.0001613 | Pa×s | 576.76 | Joback Calculated Property |
| η | 0.0000993 | Pa×s | 640.06 | Joback Calculated Property |
| η | 0.0000667 | Pa×s | 703.36 | Joback Calculated Property |
| η | 0.0000478 | Pa×s | 766.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2,4-dimethylpent-3-yl heptyl ester.
Sources
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