Chemical Properties of Benzamide, 3-fluoro-4-trifluoromethyl-N-(2-ethylhexyl)-

InChI

InChI=1S/C16H21F4NO/c1-3-5-6-11(4-2)10-21-15(22)12-7-8-13(14(17)9-12)16(18,19)20/h7-9,11H,3-6,10H2,1-2H3,(H,21,22)

InChI Key

MBBYOFDYIBDXCN-UHFFFAOYSA-N

Formula

C16H21F4NO

SMILES

CCCCC(CC)CNC(=O)c1ccc(C(F)(F)F)c(F)c1

Molecular Weight¹

319.34

• 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°	-641.38	kJ/mol	Joback Calculated Property
ΔfH°gas	-1017.56	kJ/mol	Joback Calculated Property
ΔfusH°	38.54	kJ/mol	Joback Calculated Property
ΔvapH°	63.04	kJ/mol	Joback Calculated Property
log10WS	-5.94		Crippen Calculated Property
logPoct/wat	4.791		Crippen Calculated Property
McVol	231.170	ml/mol	McGowan Calculated Property
Pc	1562.28	kPa	Joback Calculated Property
Inp	[1883.00; 1883.00]
Inp	1883.00		NIST
Inp	1883.00		NIST
Tboil	699.57	K	Joback Calculated Property
Tc	883.23	K	Joback Calculated Property
Tfus	413.91	K	Joback Calculated Property
Vc	0.919	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[663.14; 740.26]	J/mol×K	[699.57; 883.23]
Cp,gas	663.14	J/mol×K	699.57	Joback Calculated Property
Cp,gas	678.04	J/mol×K	730.18	Joback Calculated Property
Cp,gas	692.06	J/mol×K	760.79	Joback Calculated Property
Cp,gas	705.25	J/mol×K	791.40	Joback Calculated Property
Cp,gas	717.65	J/mol×K	822.01	Joback Calculated Property
Cp,gas	729.30	J/mol×K	852.62	Joback Calculated Property
Cp,gas	740.26	J/mol×K	883.23	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 3-fluoro-4-trifluoromethyl-N-(2-ethylhexyl)-.

Sources

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

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