Chemical Properties of Benzamide, N-ethyl-N-(3-methylphenyl)-2,3,4-trifluoro-

InChI

InChI=1S/C16H14F3NO/c1-3-20(11-6-4-5-10(2)9-11)16(21)12-7-8-13(17)15(19)14(12)18/h4-9H,3H2,1-2H3

InChI Key

FKOGDUWKXPRXQB-UHFFFAOYSA-N

Formula

C16H14F3NO

SMILES

CCN(C(=O)c1ccc(F)c(F)c1F)c1cccc(C)c1

Molecular Weight¹

293.28

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization 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).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.6695		Relay (1.0) Calculated Property
ΔfG°	-332.43	kJ/mol	Joback Calculated Property
ΔfH°gas	-566.55	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	37.58	kJ/mol	Joback Calculated Property
ΔvapH°	87.62	kJ/mol	Relay (1.0) Calculated Property
IE	8.18	eV	Relay (1.0) Calculated Property
log10WS	-5.22		Relay (1.0) Calculated Property
logPoct/wat	4.079		Crippen Calculated Property
McVol	205.640	ml/mol	McGowan Calculated Property
Pc	2018.13	kPa	Joback Calculated Property
Inp	[1763.00; 1763.00]
Inp	1763.00		NIST
Inp	1763.00		NIST
Tboil	614.39	K	Relay (1.0) Calculated Property
Tc	850.84	K	Relay (1.0) Calculated Property
Tfus	337.07	K	Relay (1.0) Calculated Property
Vc	0.751	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[551.57; 622.13]	J/mol×K	[702.88; 910.73]
Cp,gas	551.57	J/mol×K	702.88	Joback Calculated Property
Cp,gas	565.56	J/mol×K	737.52	Joback Calculated Property
Cp,gas	578.59	J/mol×K	772.16	Joback Calculated Property
Cp,gas	590.72	J/mol×K	806.80	Joback Calculated Property
Cp,gas	602.00	J/mol×K	841.45	Joback Calculated Property
Cp,gas	612.45	J/mol×K	876.09	Joback Calculated Property
Cp,gas	622.13	J/mol×K	910.73	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, N-ethyl-N-(3-methylphenyl)-2,3,4-trifluoro-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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