Chemical Properties of 4-Fluoro-2-trifluoromethylbenzamide, N-(3-methylphenyl)-

4-Fluoro-2-trifluoromethylbenzamide, N-(3-methylphenyl)-

InChI
InChI=1S/C15H11F4NO/c1-9-3-2-4-11(7-9)20-14(21)12-6-5-10(16)8-13(12)15(17,18)19/h2-8H,1H3,(H,20,21)
InChI Key
IFRJXSLFHFAACR-UHFFFAOYSA-N
Formula
C15H11F4NO
SMILES
Cc1cccc(NC(=O)c2ccc(F)cc2C(F)(F)F)c1
Molecular Weight1
297.25
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Physical Properties

Property Value Unit Source
ΔfusH° 33.12 kJ/mol Joback Calculated Property
IE 8.30 eV Relay (1.0) Calculated Property
log10WS -5.03 Relay (1.0) Calculated Property
logPoct/wat 4.405 Crippen Calculated Property
McVol 193.320 ml/mol McGowan Calculated Property
Inp [1931.00; 1931.00]   Show Hide
Inp 1931.00 NIST
Inp 1931.00 NIST
Tboil 608.53 K Relay (1.0) Calculated Property
Tfus 384.22 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 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 [265.27; 602.68] 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-2.96200e+01
Coefficient B1.31372e+00
Coefficient C-9.20780e-04
Coefficient D2.39360e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 265.27 J/mol×K 273.00 Calculated Property
Cp,gas 330.50 J/mol×K 353.78 Calculated Property
Cp,gas 387.03 J/mol×K 434.56 Calculated Property
Cp,gas 435.61 J/mol×K 515.33 Calculated Property
Cp,gas 477.01 J/mol×K 596.11 Calculated Property
Cp,gas 511.97 J/mol×K 676.89 Calculated Property
Cp,gas 541.27 J/mol×K 757.67 Calculated Property
Cp,gas 565.65 J/mol×K 838.44 Calculated Property
Cp,gas 585.86 J/mol×K 919.22 Calculated Property
Cp,gas 602.68 J/mol×K 1000.00 Calculated Property

Similar Compounds

3-Fluoro-6-trifluoromethylbenzamide, N-(3-methylphenyl)-. 2-Fluoro-6-trifluoromethylbenzamide, N-(3-methylphenyl)-. 4-Fluoro-2-trifluoromethylbenzamide, N-(2-iodo-4-methylphenyl)-. 4-Fluoro-2-trifluoromethylbenzamide, N-(3-chlorophenyl)-. 4-Fluoro-2-trifluoromethylbenzamide, N-(1-naphthyl)-. 4-Fluoro-2-trifluoromethylbenzamide, N-(4-methoxyphenyl)-. 4-Fluoro-2-trifluoromethylbenzamide, N-(4-bromophenyl)-. 3-Fluoro-6-trifluoromethylbenzamide, N-(2-iodo-4-methylphenyl)-. 4-Fluoro-2-trifluoromethylbenzamide, N-(3-chloro-4-fluorophenyl)-. 4-Fluoro-2-trifluoromethylbenzamide, N-(2,5-dimethoxyphenyl)-. 3-Fluoro-6-trifluoromethylbenzamide, N-(4-methoxyphenyl)-. 3-Fluoro-5-trifluoromethylbenzamide, N-(3-methylphenyl)-. 2-Fluoro-6-trifluoromethylbenzamide, N-(2-iodo-4-methylphenyl)-. 3-Fluoro-6-trifluoromethylbenzamide, N-(3-chlorophenyl)-. Benzamide, N-(2-fluorophenyl)-2-trifluoromethyl-.

Find more compounds similar to 4-Fluoro-2-trifluoromethylbenzamide, N-(3-methylphenyl)-.

Sources

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