Chemical Properties of Benzamide, 3-(trifluoromethyl)-N-pentyl-

InChI

InChI=1S/C13H16F3NO/c1-2-3-4-8-17-12(18)10-6-5-7-11(9-10)13(14,15)16/h5-7,9H,2-4,8H2,1H3,(H,17,18)

InChI Key

OZGQYHZOXAWJRZ-UHFFFAOYSA-N

Formula

C13H16F3NO

SMILES

CCCCCNC(=O)c1cccc(C(F)(F)F)c1

Molecular Weight¹

259.27

• 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°	-459.76	kJ/mol	Joback Calculated Property
ΔfH°gas	-742.78	kJ/mol	Joback Calculated Property
ΔfusH°	31.60	kJ/mol	Joback Calculated Property
ΔvapH°	56.91	kJ/mol	Joback Calculated Property
log10WS	-4.59		Crippen Calculated Property
logPoct/wat	3.625		Crippen Calculated Property
McVol	187.130	ml/mol	McGowan Calculated Property
Pc	2085.03	kPa	Joback Calculated Property
Inp	[1716.00; 1716.00]
Inp	1716.00		NIST
Inp	1716.00		NIST
Tboil	627.12	K	Joback Calculated Property
Tc	817.97	K	Joback Calculated Property
Tfus	381.99	K	Joback Calculated Property
Vc	0.740	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[497.26; 569.88]	J/mol×K	[627.12; 817.97]
Cp,gas	497.26	J/mol×K	627.12	Joback Calculated Property
Cp,gas	511.41	J/mol×K	658.93	Joback Calculated Property
Cp,gas	524.69	J/mol×K	690.74	Joback Calculated Property
Cp,gas	537.13	J/mol×K	722.55	Joback Calculated Property
Cp,gas	548.77	J/mol×K	754.36	Joback Calculated Property
Cp,gas	559.68	J/mol×K	786.16	Joback Calculated Property
Cp,gas	569.88	J/mol×K	817.97	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 3-(trifluoromethyl)-N-pentyl-.

Sources

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

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