- InChI
- InChI=1S/C20H36O4/c1-15(11-19(3,4)5)13-23-17(21)9-10-18(22)24-14-16(2)12-20(6,7)8/h9-10,15-16H,11-14H2,1-8H3/b10-9+
- InChI Key
- HFAKSYSFJUXFQY-MDZDMXLPSA-N
- Formula
- C20H36O4
- SMILES
-
CC(COC(=O)C=CC(=O)OCC(C)CC(C)(
C)C)CC(C)(C)C - Molecular Weight1
- 340.50
- 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° | -269.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -856.57 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 31.46 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.02 | kJ/mol | Joback Calculated Property |
| log10WS | -4.81 | Crippen Calculated Property | |
| logPoct/wat | 4.774 | Crippen Calculated Property | |
| McVol | 303.240 | ml/mol | McGowan Calculated Property |
| Pc | 1156.93 | kPa | Joback Calculated Property |
| Inp | [2087.00; 2087.00] |
|
|
| Inp | 2087.00 | NIST | |
| Inp | 2087.00 | NIST | |
| Tboil | 806.40 | K | Joback Calculated Property |
| Tc | 1002.80 | K | Joback Calculated Property |
| Tfus | 429.24 | K | Joback Calculated Property |
| Vc | 1.149 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [947.01; 1040.72] | J/mol×K | [806.40; 1002.80] |
|
| Cp,gas | 947.01 | J/mol×K | 806.40 | Joback Calculated Property |
| Cp,gas | 965.16 | J/mol×K | 839.13 | Joback Calculated Property |
| Cp,gas | 982.21 | J/mol×K | 871.87 | Joback Calculated Property |
| Cp,gas | 998.24 | J/mol×K | 904.60 | Joback Calculated Property |
| Cp,gas | 1013.29 | J/mol×K | 937.33 | Joback Calculated Property |
| Cp,gas | 1027.43 | J/mol×K | 970.06 | Joback Calculated Property |
| Cp,gas | 1040.72 | J/mol×K | 1002.80 | Joback Calculated Property |
| η | [0.0000251; 0.0010923] | Pa×s | [429.24; 806.40] |
|
| η | 0.0010923 | Pa×s | 429.24 | Joback Calculated Property |
| η | 0.0003897 | Pa×s | 492.10 | Joback Calculated Property |
| η | 0.0001756 | Pa×s | 554.96 | Joback Calculated Property |
| η | 0.0000931 | Pa×s | 617.82 | Joback Calculated Property |
| η | 0.0000555 | Pa×s | 680.68 | Joback Calculated Property |
| η | 0.0000361 | Pa×s | 743.54 | Joback Calculated Property |
| η | 0.0000251 | Pa×s | 806.40 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, di(2,4,4-trimethylpentyl) ester.
Sources
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