- InChI
- InChI=1S/C24H40O4/c1-3-5-7-9-11-13-15-17-21-27-23(25)19-20-24(26)28-22-18-16-14-12-10-8-6-4-2/h11-14,19-20H,3-10,15-18,21-22H2,1-2H3/b13-11+,14-12+,20-19+
- InChI Key
- WBZFZCFYLUHDFZ-KFADKCKJSA-N
- Formula
- C24H40O4
- SMILES
-
CCCCC/C=C/CCCOC(=O)/C=C/C(=O)O
CCC/C=C/CCCCC - Molecular Weight1
- 392.58
- 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 | 1.0021 | Relay (1.0) Calculated Property | |
| ΔfG° | -228.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -899.55 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 67.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 125.18 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.02 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.18 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.462 | Crippen Calculated Property | |
| McVol | 351.000 | ml/mol | McGowan Calculated Property |
| Pc | 887.88 | kPa | Joback Calculated Property |
| Inp | [2774.00; 2774.00] |
|
|
| Inp | 2774.00 | NIST | |
| Inp | 2774.00 | NIST | |
| Tboil | 640.81 | K | Relay (1.0) Calculated Property |
| Tc | 817.78 | K | Relay (1.0) Calculated Property |
| Tfus | 291.81 | K | Relay (1.0) Calculated Property |
| Vc | 1.251 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [505.28; 1181.98] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -1.06560e+01 | |||
| Coefficient B | 2.23424e+00 | |||
| Coefficient C | -1.34400e-03 | |||
| Coefficient D | 3.02400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 505.28 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 624.94 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 731.26 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 825.18 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 907.67 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 979.67 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1042.15 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1096.05 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1142.35 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1181.98 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0007414; 0.0000281] | Pa×s | [429.66; 752.37] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.48373e+01 | |||
| Coefficient B | 3.27844e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 429.66 | |||
| Temperature range, max. | 752.37 | |||
| η | 0.0007414 | Pa×s | 429.66 | Calculated Property |
| η | 0.0004119 | Pa×s | 465.52 | Calculated Property |
| η | 0.0002489 | Pa×s | 501.37 | Calculated Property |
| η | 0.0001609 | Pa×s | 537.23 | Calculated Property |
| η | 0.0001098 | Pa×s | 573.09 | Calculated Property |
| η | 0.0000784 | Pa×s | 608.95 | Calculated Property |
| η | 0.0000581 | Pa×s | 644.80 | Calculated Property |
| η | 0.0000445 | Pa×s | 680.66 | Calculated Property |
| η | 0.0000349 | Pa×s | 716.52 | Calculated Property |
| η | 0.0000281 | Pa×s | 752.37 | Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, di(dec-4-enyl) ester.
Sources
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