Chemical Properties of Benzamide, 2-(trifluoromethyl)-N-butyl-

InChI

InChI=1S/C12H14F3NO/c1-2-3-8-16-11(17)9-6-4-5-7-10(9)12(13,14)15/h4-7H,2-3,8H2,1H3,(H,16,17)

InChI Key

FMQDDICEJGNHTL-UHFFFAOYSA-N

Formula

C12H14F3NO

SMILES

CCCCNC(=O)c1ccccc1C(F)(F)F

Molecular Weight¹

245.24

• 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°	-468.18	kJ/mol	Joback Calculated Property
ΔfH°gas	-722.14	kJ/mol	Joback Calculated Property
ΔfusH°	29.01	kJ/mol	Joback Calculated Property
ΔvapH°	54.68	kJ/mol	Joback Calculated Property
log10WS	-4.18		Crippen Calculated Property
logPoct/wat	3.235		Crippen Calculated Property
McVol	173.040	ml/mol	McGowan Calculated Property
Pc	2280.59	kPa	Joback Calculated Property
Inp	[1592.00; 1592.00]
Inp	1592.00		NIST
Inp	1592.00		NIST
Tboil	604.24	K	Joback Calculated Property
Tc	797.30	K	Joback Calculated Property
Tfus	370.72	K	Joback Calculated Property
Vc	0.683	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[447.25; 517.04]	J/mol×K	[604.24; 797.30]
Cp,gas	447.25	J/mol×K	604.24	Joback Calculated Property
Cp,gas	460.91	J/mol×K	636.42	Joback Calculated Property
Cp,gas	473.69	J/mol×K	668.59	Joback Calculated Property
Cp,gas	485.65	J/mol×K	700.77	Joback Calculated Property
Cp,gas	496.84	J/mol×K	732.95	Joback Calculated Property
Cp,gas	507.28	J/mol×K	765.13	Joback Calculated Property
Cp,gas	517.04	J/mol×K	797.30	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 2-(trifluoromethyl)-N-butyl-.

Sources

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

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