Chemical Properties of Benzamide, 4-(trifluoromethyl)-N-butyl-N-undecyl-

InChI

InChI=1S/C23H36F3NO/c1-3-5-7-8-9-10-11-12-13-19-27(18-6-4-2)22(28)20-14-16-21(17-15-20)23(24,25)26/h14-17H,3-13,18-19H2,1-2H3

InChI Key

OQHLKSXCTUWHRI-UHFFFAOYSA-N

Formula

C23H36F3NO

SMILES

CCCCCCCCCCCN(CCCC)C(=O)c1ccc(C(F)(F)F)cc1

Molecular Weight¹

399.53

• 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°	-354.17	kJ/mol	Joback Calculated Property
ΔfH°gas	-935.12	kJ/mol	Joback Calculated Property
ΔfusH°	55.42	kJ/mol	Joback Calculated Property
ΔvapH°	74.77	kJ/mol	Joback Calculated Property
log10WS	-8.16		Crippen Calculated Property
logPoct/wat	7.479		Crippen Calculated Property
McVol	328.030	ml/mol	McGowan Calculated Property
Pc	998.28	kPa	Joback Calculated Property
Inp	[3157.00; 3157.00]
Inp	3157.00		NIST
Inp	3157.00		NIST
Tboil	818.19	K	Joback Calculated Property
Tc	1005.06	K	Joback Calculated Property
Tfus	474.50	K	Joback Calculated Property
Vc	1.282	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1040.60; 1136.28]	J/mol×K	[818.19; 1005.06]
Cp,gas	1040.60	J/mol×K	818.19	Joback Calculated Property
Cp,gas	1058.92	J/mol×K	849.33	Joback Calculated Property
Cp,gas	1076.20	J/mol×K	880.48	Joback Calculated Property
Cp,gas	1092.51	J/mol×K	911.62	Joback Calculated Property
Cp,gas	1107.91	J/mol×K	942.77	Joback Calculated Property
Cp,gas	1122.48	J/mol×K	973.91	Joback Calculated Property
Cp,gas	1136.28	J/mol×K	1005.06	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 4-(trifluoromethyl)-N-butyl-N-undecyl-.

Sources

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

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