Chemical Properties of Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-pentyl-

InChI

InChI=1S/C18H25F4NO/c1-3-5-7-12-23(13-8-6-4-2)17(24)14-10-9-11-15(16(14)19)18(20,21)22/h9-11H,3-8,12-13H2,1-2H3

InChI Key

ACWHJPUSCDJFGN-UHFFFAOYSA-N

Formula

C18H25F4NO

SMILES

CCCCCN(CCCCC)C(=O)c1cccc(C(F)(F)F)c1F

Molecular Weight¹

347.39

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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
ω	0.8157		Relay (1.0) Calculated Property
ΔfG°	-600.71	kJ/mol	Joback Calculated Property
ΔfH°gas	-1093.93	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	45.16	kJ/mol	Joback Calculated Property
ΔvapH°	77.86	kJ/mol	Relay (1.0) Calculated Property
IE	8.71	eV	Relay (1.0) Calculated Property
log10WS	-5.77		Relay (1.0) Calculated Property
logPoct/wat	5.667		Crippen Calculated Property
McVol	259.350	ml/mol	McGowan Calculated Property
Pc	1327.14	kPa	Joback Calculated Property
Inp	[2591.00; 2591.00]
Inp	2591.00		NIST
Inp	2591.00		NIST
Tboil	603.00	K	Relay (1.0) Calculated Property
Tc	776.10	K	Relay (1.0) Calculated Property
Tfus	296.95	K	Relay (1.0) Calculated Property
Vc	0.961	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[755.01; 839.07]	J/mol×K	[708.04; 885.04]
Cp,gas	755.01	J/mol×K	708.04	Joback Calculated Property
Cp,gas	771.12	J/mol×K	737.54	Joback Calculated Property
Cp,gas	786.32	J/mol×K	767.04	Joback Calculated Property
Cp,gas	800.67	J/mol×K	796.54	Joback Calculated Property
Cp,gas	814.22	J/mol×K	826.04	Joback Calculated Property
Cp,gas	827.00	J/mol×K	855.54	Joback Calculated Property
Cp,gas	839.07	J/mol×K	885.04	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 2-fluoro-3-trifluoromethyl-N-pentyl-N-pentyl-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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