Chemical Properties of Benzamide, 3-trifluoromethyl-N-ethyl-N-isobutyl-

InChI

InChI=1S/C14H18F3NO/c1-4-18(9-10(2)3)13(19)11-6-5-7-12(8-11)14(15,16)17/h5-8,10H,4,9H2,1-3H3

InChI Key

PDMJCVJBXYWJDH-UHFFFAOYSA-N

Formula

C14H18F3NO

SMILES

CCN(CC(C)C)C(=O)c1cccc(C(F)(F)F)c1

Molecular Weight¹

273.29

• 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°	-432.39	kJ/mol	Joback Calculated Property
ΔfH°gas	-754.64	kJ/mol	Joback Calculated Property
ΔfusH°	28.59	kJ/mol	Joback Calculated Property
ΔvapH°	54.35	kJ/mol	Joback Calculated Property
log10WS	-4.15		Crippen Calculated Property
logPoct/wat	3.824		Crippen Calculated Property
McVol	201.220	ml/mol	McGowan Calculated Property
Pc	1901.92	kPa	Joback Calculated Property
Inp	[1728.00; 1728.00]
Inp	1728.00		NIST
Inp	1728.00		NIST
Tboil	611.83	K	Joback Calculated Property
Tc	800.78	K	Joback Calculated Property
Tfus	358.07	K	Joback Calculated Property
Vc	0.772	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[532.25; 613.09]	J/mol×K	[611.83; 800.78]
Cp,gas	532.25	J/mol×K	611.83	Joback Calculated Property
Cp,gas	548.00	J/mol×K	643.32	Joback Calculated Property
Cp,gas	562.78	J/mol×K	674.81	Joback Calculated Property
Cp,gas	576.62	J/mol×K	706.30	Joback Calculated Property
Cp,gas	589.59	J/mol×K	737.80	Joback Calculated Property
Cp,gas	601.73	J/mol×K	769.29	Joback Calculated Property
Cp,gas	613.09	J/mol×K	800.78	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, 3-trifluoromethyl-N-ethyl-N-isobutyl-.

Sources

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

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