Chemical Properties of Benzamide, 3-trifluoromethyl-N-ethyl-N-hept-2-yl-

InChI

InChI=1S/C17H24F3NO/c1-4-6-7-9-13(3)21(5-2)16(22)14-10-8-11-15(12-14)17(18,19)20/h8,10-13H,4-7,9H2,1-3H3

InChI Key

PQNHEJQLXMHPLA-UHFFFAOYSA-N

Formula

C17H24F3NO

SMILES

CCCCCC(C)N(CC)C(=O)c1cccc(C(F)(F)F)c1

Molecular Weight¹

315.37

• 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	0.6971		Relay (1.0) Calculated Property
ΔfG°	-407.13	kJ/mol	Joback Calculated Property
ΔfH°gas	-910.77	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	36.36	kJ/mol	Joback Calculated Property
ΔvapH°	78.28	kJ/mol	Relay (1.0) Calculated Property
IE	8.61	eV	Relay (1.0) Calculated Property
log10WS	-5.00		Relay (1.0) Calculated Property
logPoct/wat	5.136		Crippen Calculated Property
McVol	243.490	ml/mol	McGowan Calculated Property
Pc	1501.15	kPa	Joback Calculated Property
Inp	[1961.00; 1961.00]
Inp	1961.00		NIST
Inp	1961.00		NIST
Tboil	588.68	K	Relay (1.0) Calculated Property
Tc	778.53	K	Relay (1.0) Calculated Property
Tfus	307.83	K	Relay (1.0) Calculated Property
Vc	0.883	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[692.22; 778.79]	J/mol×K	[680.47; 864.77]
Cp,gas	692.22	J/mol×K	680.47	Joback Calculated Property
Cp,gas	708.95	J/mol×K	711.19	Joback Calculated Property
Cp,gas	724.68	J/mol×K	741.90	Joback Calculated Property
Cp,gas	739.48	J/mol×K	772.62	Joback Calculated Property
Cp,gas	753.40	J/mol×K	803.34	Joback Calculated Property
Cp,gas	766.48	J/mol×K	834.06	Joback Calculated Property
Cp,gas	778.79	J/mol×K	864.77	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 3-trifluoromethyl-N-ethyl-N-hept-2-yl-.

Sources

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

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