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

InChI

InChI=1S/C12H15F2NO/c1-3-4-7-15-12(16)10-9(13)6-5-8(2)11(10)14/h5-6H,3-4,7H2,1-2H3,(H,15,16)

InChI Key

ZCCNMOWICAHCFV-UHFFFAOYSA-N

Formula

C12H15F2NO

SMILES

CCCCNC(=O)c1c(F)ccc(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°	-295.47	kJ/mol	Joback Calculated Property
ΔfH°gas	-540.22	kJ/mol	Joback Calculated Property
ΔfusH°	32.57	kJ/mol	Joback Calculated Property
ΔvapH°	58.12	kJ/mol	Joback Calculated Property
log10WS	-4.21		Crippen Calculated Property
logPoct/wat	2.803		Crippen Calculated Property
McVol	171.270	ml/mol	McGowan Calculated Property
Pc	2271.90	kPa	Joback Calculated Property
Inp	[1740.00; 1740.00]
Inp	1740.00		NIST
Inp	1740.00		NIST
Tboil	618.16	K	Joback Calculated Property
Tc	811.33	K	Joback Calculated Property
Tfus	392.75	K	Joback Calculated Property
Vc	0.676	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[434.72; 504.05]	J/mol×K	[618.16; 811.33]
Cp,gas	434.72	J/mol×K	618.16	Joback Calculated Property
Cp,gas	447.95	J/mol×K	650.35	Joback Calculated Property
Cp,gas	460.49	J/mol×K	682.55	Joback Calculated Property
Cp,gas	472.35	J/mol×K	714.74	Joback Calculated Property
Cp,gas	483.55	J/mol×K	746.94	Joback Calculated Property
Cp,gas	494.11	J/mol×K	779.13	Joback Calculated Property
Cp,gas	504.05	J/mol×K	811.33	Joback Calculated Property

Similar Compounds

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

Sources

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

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