Chemical Properties of Succinic acid, hexadecyl 1-phenyl-2,2,2-trifluoroethyl ester

Succinic acid, hexadecyl 1-phenyl-2,2,2-trifluoroethyl ester

InChI
InChI=1S/C28H43F3O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-23-34-25(32)21-22-26(33)35-27(28(29,30)31)24-19-16-15-17-20-24/h15-17,19-20,27H,2-14,18,21-23H2,1H3
InChI Key
FKPMNGPOMUMOEC-UHFFFAOYSA-N
Formula
C28H43F3O4
SMILES
CCCCCCCCCCCCCCCCOC(=O)CCC(=O)OC(c1ccccc1)C(F)(F)F
Molecular Weight1
500.63
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Physical Properties

Property Value Unit Source
ΔfusH° 69.36 kJ/mol Joback Calculated Property
ΔvapH° 129.85 kJ/mol Relay (1.0) Calculated Property
log10WS -7.81 Relay (1.0) Calculated Property
logPoct/wat 8.638 Crippen Calculated Property
McVol 401.810 ml/mol McGowan Calculated Property
Pc 741.24 kPa Joback Calculated Property
Inp [2988.00; 2988.00]   Show Hide
Inp 2988.00 NIST
Inp 2988.00 NIST
Tboil 674.78 K Relay (1.0) Calculated Property
Tfus 314.36 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [597.71; 1384.79] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.35330e+01
Coefficient B2.64242e+00
Coefficient C-1.56560e-03
Coefficient D3.21500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 597.71 J/mol×K 273.00 Calculated Property
Cp,gas 739.58 J/mol×K 353.78 Calculated Property
Cp,gas 865.48 J/mol×K 434.56 Calculated Property
Cp,gas 976.42 J/mol×K 515.33 Calculated Property
Cp,gas 1073.41 J/mol×K 596.11 Calculated Property
Cp,gas 1157.48 J/mol×K 676.89 Calculated Property
Cp,gas 1229.63 J/mol×K 757.67 Calculated Property
Cp,gas 1290.89 J/mol×K 838.44 Calculated Property
Cp,gas 1342.27 J/mol×K 919.22 Calculated Property
Cp,gas 1384.79 J/mol×K 1000.00 Calculated Property

Similar Compounds

Succinic acid, dodecyl 1-phenyl-2,2,2-trifluoroethyl ester. Succinic acid, heptyl 1-phenyl-2,2,2-trifluoroethyl ester. Succinic acid, octyl 1-phenyl-2,2,2-trifluoroethyl ester. Succinic acid, pentadecyl 1-phenyl-2,2,2-trifluoroethyl ester. Succinic acid, nonyl 1-phenyl-2,2,2-trifluoroethyl ester. Succinic acid, 1-phenyl-2,2,2-trifluoroethyl tridecyl ester. Succinic acid, 1-phenyl-2,2,2-trifluoroethyl undecyl ester. Succinic acid, decyl 1-phenyl-2,2,2-trifluoroethyl ester. Succinic acid, 1-phenyl-2,2,2-trifluoroethyl tetradecyl ester. Succinic acid, hexyl 1-phenyl-2,2,2-trifluoroethyl ester. Succinic acid, pentyl 1-phenyl-2,2,2-trifluoroethyl ester. Glutaric acid, octadecyl 1-phenyl-2,2,2-trifluoroethyl ester. Glutaric acid, 1-phenyl-2,2,2-trifluoroethyl tetradecyl ester. Glutaric acid, 1-phenyl-2,2,2-trifluoroethyl tridecyl ester. Glutaric acid, pentadecyl 1-phenyl-2,2,2-trifluoroethyl ester.

Find more compounds similar to Succinic acid, hexadecyl 1-phenyl-2,2,2-trifluoroethyl ester.

Sources

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