Chemical Properties of Benzamide, 2,6-difluoro-3-methyl-N-(2,6-difluoro-3-methylbenzoyl)-N-hexyl-

InChI

InChI=1S/C22H23F4NO2/c1-4-5-6-7-12-27(21(28)17-15(23)10-8-13(2)19(17)25)22(29)18-16(24)11-9-14(3)20(18)26/h8-11H,4-7,12H2,1-3H3

InChI Key

IKRSWCRFDKFHDW-UHFFFAOYSA-N

Formula

C22H23F4NO2

SMILES

CCCCCCN(C(=O)c1c(F)ccc(C)c1F)C(=O)c1c(F)ccc(C)c1F

Molecular Weight¹

409.42

• 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°	-624.90	kJ/mol	Joback Calculated Property
ΔfH°gas	-1035.24	kJ/mol	Joback Calculated Property
ΔfusH°	57.02	kJ/mol	Joback Calculated Property
ΔvapH°	85.36	kJ/mol	Joback Calculated Property
log10WS	-7.95		Crippen Calculated Property
logPoct/wat	5.723		Crippen Calculated Property
McVol	293.520	ml/mol	McGowan Calculated Property
Pc	1262.85	kPa	Joback Calculated Property
Inp	[2502.00; 2502.00]
Inp	2502.00		NIST
Inp	2502.00		NIST
Tboil	903.26	K	Joback Calculated Property
Tc	1110.94	K	Joback Calculated Property
Tfus	600.35	K	Joback Calculated Property
Vc	1.153	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[907.81; 975.21]	J/mol×K	[903.26; 1110.94]
Cp,gas	907.81	J/mol×K	903.26	Joback Calculated Property
Cp,gas	921.45	J/mol×K	937.87	Joback Calculated Property
Cp,gas	934.06	J/mol×K	972.49	Joback Calculated Property
Cp,gas	945.69	J/mol×K	1007.10	Joback Calculated Property
Cp,gas	956.40	J/mol×K	1041.71	Joback Calculated Property
Cp,gas	966.22	J/mol×K	1076.32	Joback Calculated Property
Cp,gas	975.21	J/mol×K	1110.94	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 2,6-difluoro-3-methyl-N-(2,6-difluoro-3-methylbenzoyl)-N-hexyl-.

Sources

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

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