Chemical Properties of Benzamide, 3-chloro-2-fluoro-N-(3-chloro-2-fluorobenzoyl)-N-propyl-

InChI

InChI=1S/C17H13Cl2F2NO2/c1-2-9-22(16(23)10-5-3-7-12(18)14(10)20)17(24)11-6-4-8-13(19)15(11)21/h3-8H,2,9H2,1H3

InChI Key

COQCPMUJPFWXIW-UHFFFAOYSA-N

Formula

C17H13Cl2F2NO2

SMILES

CCCN(C(=O)c1cccc(Cl)c1F)C(=O)c1cccc(Cl)c1F

Molecular Weight¹

372.19

• 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	0.7770		Relay (1.0) Calculated Property
ΔfG°	-281.98	kJ/mol	Joback Calculated Property
ΔfH°gas	-561.55	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	47.09	kJ/mol	Joback Calculated Property
ΔvapH°	97.44	kJ/mol	Relay (1.0) Calculated Property
IE	9.02	eV	Relay (1.0) Calculated Property
log10WS	-6.31		Relay (1.0) Calculated Property
logPoct/wat	4.964		Crippen Calculated Property
McVol	244.010	ml/mol	McGowan Calculated Property
Pc	1910.24	kPa	Joback Calculated Property
Inp	[2348.00; 2348.00]
Inp	2348.00		NIST
Inp	2348.00		NIST
Tboil	648.98	K	Relay (1.0) Calculated Property
Tc	926.69	K	Relay (1.0) Calculated Property
Tfus	356.84	K	Relay (1.0) Calculated Property
Vc	0.871	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[656.80; 709.44]	J/mol×K	[855.22; 1080.69]
Cp,gas	656.80	J/mol×K	855.22	Joback Calculated Property
Cp,gas	667.72	J/mol×K	892.80	Joback Calculated Property
Cp,gas	677.70	J/mol×K	930.38	Joback Calculated Property
Cp,gas	686.80	J/mol×K	967.95	Joback Calculated Property
Cp,gas	695.08	J/mol×K	1005.53	Joback Calculated Property
Cp,gas	702.61	J/mol×K	1043.11	Joback Calculated Property
Cp,gas	709.44	J/mol×K	1080.69	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 3-chloro-2-fluoro-N-(3-chloro-2-fluorobenzoyl)-N-propyl-.

Sources

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

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