- InChI
- InChI=1S/C22H32O6/c1-4-5-6-7-8-9-10-11-16-27-21(23)14-15-22(24)28-18-12-13-19(25-2)20(17-18)26-3/h12-15,17H,4-11,16H2,1-3H3/b15-14+
- InChI Key
- QDBMQXJLGLUEKA-CCEZHUSRSA-N
- Formula
- C22H32O6
- SMILES
-
CCCCCCCCCCOC(=O)C=CC(=O)Oc1ccc
(OC)c(OC)c1 - Molecular Weight1
- 392.49
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 1.1412 | Relay (1.0) Calculated Property | |
| ΔfG° | -370.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1032.64 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 54.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 114.96 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.34 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.96 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.849 | Crippen Calculated Property | |
| McVol | 319.400 | ml/mol | McGowan Calculated Property |
| Pc | 1173.63 | kPa | Joback Calculated Property |
| Inp | 2998.00 | NIST | |
| Tboil | 659.69 | K | Relay (1.0) Calculated Property |
| Tc | 872.66 | K | Relay (1.0) Calculated Property |
| Tfus | 348.39 | K | Relay (1.0) Calculated Property |
| Vc | 1.176 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1027.29; 1095.07] | J/mol×K | [940.98; 1153.62] | 
|
| Cp,gas | 1027.29 | J/mol×K | 940.98 | Joback Calculated Property |
| Cp,gas | 1042.11 | J/mol×K | 976.42 | Joback Calculated Property |
| Cp,gas | 1055.50 | J/mol×K | 1011.86 | Joback Calculated Property |
| Cp,gas | 1067.49 | J/mol×K | 1047.30 | Joback Calculated Property |
| Cp,gas | 1078.07 | J/mol×K | 1082.74 | Joback Calculated Property |
| Cp,gas | 1087.26 | J/mol×K | 1118.18 | Joback Calculated Property |
| Cp,gas | 1095.07 | J/mol×K | 1153.62 | Joback Calculated Property |
| η | [0.0000204; 0.0001902] | Pa×s | [572.86; 940.98] |
|
| η | 0.0001902 | Pa×s | 572.86 | Joback Calculated Property |
| η | 0.0001095 | Pa×s | 634.21 | Joback Calculated Property |
| η | 0.0000695 | Pa×s | 695.57 | Joback Calculated Property |
| η | 0.0000475 | Pa×s | 756.92 | Joback Calculated Property |
| η | 0.0000343 | Pa×s | 818.27 | Joback Calculated Property |
| η | 0.0000260 | Pa×s | 879.63 | Joback Calculated Property |
| η | 0.0000204 | Pa×s | 940.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, decyl 3,4-dimethoxyphenyl ester.
Sources
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