- InChI
- InChI=1S/C16H28O4/c1-3-5-6-7-8-9-10-11-14-20-16(18)13-12-15(17)19-4-2/h8-9H,3-7,10-14H2,1-2H3/b9-8+
- InChI Key
- ZESSYMHCPGIGOA-CMDGGOBGSA-N
- Formula
- C16H28O4
- SMILES
- CCCCCC=CCCCOC(=O)CCC(=O)OCC
- Molecular Weight1
- 284.39
- 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 | 0.8045 | Relay (1.0) Calculated Property | |
| ΔfG° | -456.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -925.32 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 46.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.91 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.84 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.00 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.790 | Crippen Calculated Property | |
| McVol | 246.880 | ml/mol | McGowan Calculated Property |
| Pc | 1379.91 | kPa | Joback Calculated Property |
| Inp | 1936.00 | NIST | |
| Tboil | 580.85 | K | Relay (1.0) Calculated Property |
| Tc | 748.98 | K | Relay (1.0) Calculated Property |
| Tfus | 242.58 | K | Relay (1.0) Calculated Property |
| Vc | 0.928 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [363.57; 830.42] | 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 | 2.49800e+01 | |||
| Coefficient B | 1.43424e+00 | |||
| Coefficient C | -7.41200e-04 | |||
| Coefficient D | 1.12400e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 363.57 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 444.59 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 517.49 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 582.63 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 640.37 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 691.06 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 735.05 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 772.71 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 804.38 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 830.42 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0023864; 0.0001082] | Pa×s | [349.66; 603.31] |
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 | -1.33956e+01 | |||
| Coefficient B | 2.57268e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 349.66 | |||
| Temperature range, max. | 603.31 | |||
| η | 0.0023864 | Pa×s | 349.66 | Calculated Property |
| η | 0.0013785 | Pa×s | 377.84 | Calculated Property |
| η | 0.0008593 | Pa×s | 406.03 | Calculated Property |
| η | 0.0005696 | Pa×s | 434.21 | Calculated Property |
| η | 0.0003969 | Pa×s | 462.39 | Calculated Property |
| η | 0.0002883 | Pa×s | 490.57 | Calculated Property |
| η | 0.0002168 | Pa×s | 518.76 | Calculated Property |
| η | 0.0001679 | Pa×s | 546.94 | Calculated Property |
| η | 0.0001334 | Pa×s | 575.12 | Calculated Property |
| η | 0.0001082 | Pa×s | 603.31 | Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, dec-4-enyl ethyl ester.
Sources
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