Chemical Properties of Benzamide, 2,6-difluoro-3-methyl-N-isobutyl-

InChI

InChI=1S/C12H15F2NO/c1-7(2)6-15-12(16)10-9(13)5-4-8(3)11(10)14/h4-5,7H,6H2,1-3H3,(H,15,16)

InChI Key

JSSZGAHSICHRNG-UHFFFAOYSA-N

Formula

C12H15F2NO

SMILES

Cc1ccc(F)c(C(=O)NCC(C)C)c1F

Molecular Weight¹

227.25

• 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°	-297.91	kJ/mol	Joback Calculated Property
ΔfH°gas	-545.50	kJ/mol	Joback Calculated Property
ΔfusH°	29.04	kJ/mol	Joback Calculated Property
ΔvapH°	57.73	kJ/mol	Joback Calculated Property
log10WS	-3.97		Crippen Calculated Property
logPoct/wat	2.659		Crippen Calculated Property
McVol	171.270	ml/mol	McGowan Calculated Property
Pc	2289.32	kPa	Joback Calculated Property
Inp	[1693.00; 1693.00]
Inp	1693.00		NIST
Inp	1693.00		NIST
Tboil	617.72	K	Joback Calculated Property
Tc	814.47	K	Joback Calculated Property
Tfus	377.75	K	Joback Calculated Property
Vc	0.670	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[435.17; 505.74]	J/mol×K	[617.72; 814.47]
Cp,gas	435.17	J/mol×K	617.72	Joback Calculated Property
Cp,gas	448.69	J/mol×K	650.51	Joback Calculated Property
Cp,gas	461.49	J/mol×K	683.30	Joback Calculated Property
Cp,gas	473.57	J/mol×K	716.09	Joback Calculated Property
Cp,gas	484.96	J/mol×K	748.88	Joback Calculated Property
Cp,gas	495.67	J/mol×K	781.67	Joback Calculated Property
Cp,gas	505.74	J/mol×K	814.47	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 2,6-difluoro-3-methyl-N-isobutyl-.

Sources

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

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