- InChI
- InChI=1S/C24H44O4/c1-5-7-9-11-13-15-17-21(3)27-23(25)19-20-24(26)28-22(4)18-16-14-12-10-8-6-2/h19-22H,5-18H2,1-4H3/b20-19+
- InChI Key
- JTBIRPAFIJUFMV-FMQUCBEESA-N
- Formula
- C24H44O4
- SMILES
-
CCCCCCCCC(C)OC(=O)/C=C/C(=O)OC
(C)CCCCCCCC - Molecular Weight1
- 396.61
- 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 | 1.0814 | Relay (1.0) Calculated Property | |
| ΔfG° | -394.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1097.21 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 59.81 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 117.68 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.99 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.39 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.907 | Crippen Calculated Property | |
| McVol | 359.600 | ml/mol | McGowan Calculated Property |
| Pc | 843.09 | kPa | Joback Calculated Property |
| Inp | 2702.00 | NIST | |
| Tboil | 619.76 | K | Relay (1.0) Calculated Property |
| Tc | 799.41 | K | Relay (1.0) Calculated Property |
| Tfus | 306.54 | K | Relay (1.0) Calculated Property |
| Vc | 1.358 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [532.65; 1244.22] | 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 | 1.43440e+01 | |||
| Coefficient B | 2.20608e+00 | |||
| Coefficient C | -1.18280e-03 | |||
| Coefficient D | 2.06600e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 532.65 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 655.92 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 766.60 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 865.37 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 952.87 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1029.76 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1096.68 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1154.30 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1203.26 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1244.22 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0013297; 0.0000319] | Pa×s | [409.82; 744.29] |
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 | -1.49230e+01 | |||
| Coefficient B | 3.40160e+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. | 409.82 | |||
| Temperature range, max. | 744.29 | |||
| η | 0.0013297 | Pa×s | 409.82 | Calculated Property |
| η | 0.0006669 | Pa×s | 446.98 | Calculated Property |
| η | 0.0003718 | Pa×s | 484.15 | Calculated Property |
| η | 0.0002253 | Pa×s | 521.31 | Calculated Property |
| η | 0.0001460 | Pa×s | 558.47 | Calculated Property |
| η | 0.0000998 | Pa×s | 595.64 | Calculated Property |
| η | 0.0000714 | Pa×s | 632.80 | Calculated Property |
| η | 0.0000530 | Pa×s | 669.96 | Calculated Property |
| η | 0.0000406 | Pa×s | 707.13 | Calculated Property |
| η | 0.0000319 | Pa×s | 744.29 | Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, di(2-decyl) ester.
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