Chemical Properties of Benzamide, N-(3-chlorophenyl)-3-trifluoromethyl-

InChI

InChI=1S/C14H9ClF3NO/c15-11-5-2-6-12(8-11)19-13(20)9-3-1-4-10(7-9)14(16,17)18/h1-8H,(H,19,20)

InChI Key

CGDSIFCHWCLKDE-UHFFFAOYSA-N

Formula

C14H9ClF3NO

SMILES

O=C(Nc1cccc(Cl)c1)c1cccc(C(F)(F)F)c1

Molecular Weight¹

299.68

• 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	0.6334		Relay (1.0) Calculated Property
ΔfG°	-360.49	kJ/mol	Joback Calculated Property
ΔfH°gas	-668.19	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	32.04	kJ/mol	Joback Calculated Property
ΔvapH°	88.81	kJ/mol	Relay (1.0) Calculated Property
IE	8.72	eV	Relay (1.0) Calculated Property
log10WS	-5.21		Relay (1.0) Calculated Property
logPoct/wat	4.611		Crippen Calculated Property
McVol	189.700	ml/mol	McGowan Calculated Property
Pc	2482.59	kPa	Joback Calculated Property
Inp	[2080.00; 2080.00]
Inp	2080.00		NIST
Inp	2080.00		NIST
Tboil	612.95	K	Relay (1.0) Calculated Property
Tc	892.49	K	Relay (1.0) Calculated Property
Tfus	389.72	K	Relay (1.0) Calculated Property
Vc	0.671	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[489.70; 546.25]	J/mol×K	[719.09; 948.18]
Cp,gas	489.70	J/mol×K	719.09	Joback Calculated Property
Cp,gas	501.44	J/mol×K	757.27	Joback Calculated Property
Cp,gas	512.14	J/mol×K	795.45	Joback Calculated Property
Cp,gas	521.89	J/mol×K	833.64	Joback Calculated Property
Cp,gas	530.76	J/mol×K	871.82	Joback Calculated Property
Cp,gas	538.86	J/mol×K	910.00	Joback Calculated Property
Cp,gas	546.25	J/mol×K	948.18	Joback Calculated Property

Similar Compounds

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

Sources

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

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