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

InChI

InChI=1S/C13H7BrF3NO/c14-8-3-1-2-4-10(8)18-13(19)7-5-6-9(15)12(17)11(7)16/h1-6H,(H,18,19)

InChI Key

GEMNMIUWKPRTOY-UHFFFAOYSA-N

Formula

C13H7BrF3NO

SMILES

O=C(Nc1ccccc1Br)c1ccc(F)c(F)c1F

Molecular Weight¹

330.10

• 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).
• 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
ΔfG°	-364.76	kJ/mol	Joback Calculated Property
ΔfH°gas	-505.58	kJ/mol	Joback Calculated Property
ΔfusH°	37.18	kJ/mol	Joback Calculated Property
ΔvapH°	68.90	kJ/mol	Joback Calculated Property
log10WS	-5.61		Crippen Calculated Property
logPoct/wat	4.119		Crippen Calculated Property
McVol	180.870	ml/mol	McGowan Calculated Property
Pc	2909.25	kPa	Joback Calculated Property
Inp	[1705.00; 1705.00]
Inp	1705.00		NIST
Inp	1705.00		NIST
Tboil	738.13	K	Joback Calculated Property
Tc	968.25	K	Joback Calculated Property
Tfus	503.35	K	Joback Calculated Property
Vc	0.705	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[442.21; 492.03]	J/mol×K	[738.13; 968.25]
Cp,gas	442.21	J/mol×K	738.13	Joback Calculated Property
Cp,gas	452.44	J/mol×K	776.48	Joback Calculated Property
Cp,gas	461.84	J/mol×K	814.84	Joback Calculated Property
Cp,gas	470.44	J/mol×K	853.19	Joback Calculated Property
Cp,gas	478.31	J/mol×K	891.55	Joback Calculated Property
Cp,gas	485.49	J/mol×K	929.90	Joback Calculated Property
Cp,gas	492.03	J/mol×K	968.25	Joback Calculated Property

Similar Compounds

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

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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