Chemical Properties of trans-Cinnamamide, N-(3-chlorophenyl)-3-trifluoromethyl-

InChI

InChI=1S/C16H11ClF3NO/c17-13-5-2-6-14(10-13)21-15(22)8-7-11-3-1-4-12(9-11)16(18,19)20/h1-10H,(H,21,22)/b8-7+

InChI Key

SMMFWYAGPPOQMC-BQYQJAHWSA-N

Formula

C16H11ClF3NO

SMILES

O=C(C=Cc1cccc(C(F)(F)F)c1)Nc1cccc(Cl)c1

Molecular Weight¹

325.71

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[568.81; 627.62]	J/mol×K	[769.01; 998.46]
Cp,gas	568.81	J/mol×K	769.01	Joback Calculated Property
Cp,gas	580.72	J/mol×K	807.25	Joback Calculated Property
Cp,gas	591.64	J/mol×K	845.49	Joback Calculated Property
Cp,gas	601.68	J/mol×K	883.74	Joback Calculated Property
Cp,gas	610.95	J/mol×K	921.98	Joback Calculated Property
Cp,gas	619.56	J/mol×K	960.22	Joback Calculated Property
Cp,gas	627.62	J/mol×K	998.46	Joback Calculated Property

Similar Compounds

Find more compounds similar to trans-Cinnamamide, N-(3-chlorophenyl)-3-trifluoromethyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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