Chemical Properties of Glutaric acid, di(2-fluoro-6-(trifluoromethyl)benzyl) ester

Glutaric acid, di(2-fluoro-6-(trifluoromethyl)benzyl) ester

InChI
InChI=1S/C21H16F8O4/c22-16-6-1-4-14(20(24,25)26)12(16)10-32-18(30)8-3-9-19(31)33-11-13-15(21(27,28)29)5-2-7-17(13)23/h1-2,4-7H,3,8-11H2
InChI Key
YQQTXQSGPMPLQV-UHFFFAOYSA-N
Formula
C21H16F8O4
SMILES
O=C(CCCC(=O)OCc1c(F)cccc1C(F)(F)F)OCc1c(F)cccc1C(F)(F)F
Molecular Weight1
484.34
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Physical Properties

Property Value Unit Source
ΔfusH° 55.22 kJ/mol Joback Calculated Property
logPoct/wat 5.959 Crippen Calculated Property
McVol 288.270 ml/mol McGowan Calculated Property
Inp 2593.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [442.00; 929.24] 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 A2.37850e+01
Coefficient B1.83940e+00
Coefficient C-1.19844e-03
Coefficient D2.64500e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 442.00 J/mol×K 273.00 Calculated Property
Cp,gas 536.24 J/mol×K 353.78 Calculated Property
Cp,gas 618.50 J/mol×K 434.56 Calculated Property
Cp,gas 689.62 J/mol×K 515.33 Calculated Property
Cp,gas 750.44 J/mol×K 596.11 Calculated Property
Cp,gas 801.79 J/mol×K 676.89 Calculated Property
Cp,gas 844.51 J/mol×K 757.67 Calculated Property
Cp,gas 879.43 J/mol×K 838.44 Calculated Property
Cp,gas 907.40 J/mol×K 919.22 Calculated Property
Cp,gas 929.24 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, ethyl 2-fluoro-6-(trifluoromethyl)benzyl ester. Glutaric acid, 2-fluoro-6-(trifluoromethyl)benzyl propyl ester. Succinic acid, di(2-fluoro-6-(trifluoromethyl)benzyl) ester. Glutaric acid, butyl 2-fluoro-6-(trifluoromethyl)benzyl ester. Glutaric acid, 2-fluoro-6-(trifluoromethyl)benzyl isobutyl ester. Glutaric acid, 2-fluoro-6-(trifluoromethyl)benzyl pentyl ester. Succinic acid, ethyl 2-fluoro-6-(trifluoromethyl)benzyl ester. Glutaric acid, 2-fluoro-6-(trifluoromethyl)benzyl hexyl ester. Glutaric acid, 2-fluoro-6-(trifluoromethyl)benzyl heptyl ester. Glutaric acid, 2-fluoro-6-(trifluoromethyl)benzyl nonyl ester. Glutaric acid, 2-fluoro-6-(trifluoromethyl)benzyl octyl ester. Glutaric acid, decyl 2-fluoro-6-(trifluoromethyl)benzyl ester. Glutaric acid, dodecyl 2-fluoro-6-(trifluoromethyl)benzyl ester. Glutaric acid, 2-fluoro-6-(trifluoromethyl)benzyl undecyl ester. Succinic acid, 2-fluoro-6-(trifluoromethyl)benzyl propyl ester.

Find more compounds similar to Glutaric acid, di(2-fluoro-6-(trifluoromethyl)benzyl) ester.

Sources

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