Chemical Properties of Benzamide, 2,5-di(trifluoromethyl)-N-3-methylbutyl-

InChI

InChI=1S/C14H15F6NO/c1-8(2)5-6-21-12(22)10-7-9(13(15,16)17)3-4-11(10)14(18,19)20/h3-4,7-8H,5-6H2,1-2H3,(H,21,22)

InChI Key

CPJVYJWOQOCYKV-UHFFFAOYSA-N

Formula

C14H15F6NO

SMILES

CC(C)CCNC(=O)c1cc(C(F)(F)F)ccc1C(F)(F)F

Molecular Weight¹

327.27

• 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°	-1045.00	kJ/mol	Joback Calculated Property
ΔfH°gas	-1377.25	kJ/mol	Joback Calculated Property
ΔfusH°	32.11	kJ/mol	Joback Calculated Property
ΔvapH°	55.66	kJ/mol	Joback Calculated Property
log10WS	-5.46		Crippen Calculated Property
logPoct/wat	4.500		Crippen Calculated Property
McVol	206.530	ml/mol	McGowan Calculated Property
Pc	1723.16	kPa	Joback Calculated Property
Inp	[1536.00; 1536.00]
Inp	1536.00		NIST
Inp	1536.00		NIST
Tboil	649.12	K	Joback Calculated Property
Tc	829.50	K	Joback Calculated Property
Tfus	394.97	K	Joback Calculated Property
Vc	0.833	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[575.60; 644.34]	J/mol×K	[649.12; 829.50]
Cp,gas	575.60	J/mol×K	649.12	Joback Calculated Property
Cp,gas	589.06	J/mol×K	679.18	Joback Calculated Property
Cp,gas	601.65	J/mol×K	709.25	Joback Calculated Property
Cp,gas	613.42	J/mol×K	739.31	Joback Calculated Property
Cp,gas	624.43	J/mol×K	769.37	Joback Calculated Property
Cp,gas	634.72	J/mol×K	799.44	Joback Calculated Property
Cp,gas	644.34	J/mol×K	829.50	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 2,5-di(trifluoromethyl)-N-3-methylbutyl-.

Sources

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

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