Chemical Properties of Benzamide, 3-fluoro-5-trifluoromethyl-N-hexyl-

InChI

InChI=1S/C14H17F4NO/c1-2-3-4-5-6-19-13(20)10-7-11(14(16,17)18)9-12(15)8-10/h7-9H,2-6H2,1H3,(H,19,20)

InChI Key

CSLRDTJJMLQQKK-UHFFFAOYSA-N

Formula

C14H17F4NO

SMILES

CCCCCCNC(=O)c1cc(F)cc(C(F)(F)F)c1

Molecular Weight¹

291.28

• 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°	-655.78	kJ/mol	Joback Calculated Property
ΔfH°gas	-971.00	kJ/mol	Joback Calculated Property
ΔfusH°	36.88	kJ/mol	Joback Calculated Property
ΔvapH°	58.98	kJ/mol	Joback Calculated Property
log10WS	-5.34		Crippen Calculated Property
logPoct/wat	4.155		Crippen Calculated Property
McVol	202.990	ml/mol	McGowan Calculated Property
Pc	1816.95	kPa	Joback Calculated Property
Inp	[1722.00; 1722.00]
Inp	1722.00		NIST
Inp	1722.00		NIST
Tboil	654.25	K	Joback Calculated Property
Tc	837.13	K	Joback Calculated Property
Tfus	406.37	K	Joback Calculated Property
Vc	0.814	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[556.13; 627.81]	J/mol×K	[654.25; 837.13]
Cp,gas	556.13	J/mol×K	654.25	Joback Calculated Property
Cp,gas	569.98	J/mol×K	684.73	Joback Calculated Property
Cp,gas	583.01	J/mol×K	715.21	Joback Calculated Property
Cp,gas	595.27	J/mol×K	745.69	Joback Calculated Property
Cp,gas	606.80	J/mol×K	776.17	Joback Calculated Property
Cp,gas	617.63	J/mol×K	806.65	Joback Calculated Property
Cp,gas	627.81	J/mol×K	837.13	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 3-fluoro-5-trifluoromethyl-N-hexyl-.

Sources

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

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