Chemical Properties of 2,2,2-Trifluoro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]acetamide

InChI

InChI=1S/C10H6F6N2O2/c11-9(12,13)7(19)17-5-1-2-6(4-3-5)18-8(20)10(14,15)16/h1-4H,(H,17,19)(H,18,20)

InChI Key

IRUADIGSCKQVHY-UHFFFAOYSA-N

Formula

C10H6F6N2O2

SMILES

O=C(Nc1ccc(NC(=O)C(F)(F)F)cc1)C(F)(F)F

Molecular Weight¹

300.16

• 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°	-1106.14	kJ/mol	Joback Calculated Property
ΔfH°gas	-1337.05	kJ/mol	Joback Calculated Property
ΔfusH°	32.36	kJ/mol	Joback Calculated Property
ΔvapH°	59.66	kJ/mol	Joback Calculated Property
log10WS	-3.20		Crippen Calculated Property
logPoct/wat	2.688		Crippen Calculated Property
McVol	161.720	ml/mol	McGowan Calculated Property
Pc	2651.56	kPa	Joback Calculated Property
Inp	[1621.00; 1621.00]
Inp	1621.00		NIST
Inp	1621.00		NIST
Tboil	657.10	K	Joback Calculated Property
Tc	848.61	K	Joback Calculated Property
Tfus	454.96	K	Joback Calculated Property
Vc	0.655	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[441.19; 487.71]	J/mol×K	[657.10; 848.61]
Cp,gas	441.19	J/mol×K	657.10	Joback Calculated Property
Cp,gas	450.74	J/mol×K	689.02	Joback Calculated Property
Cp,gas	459.50	J/mol×K	720.94	Joback Calculated Property
Cp,gas	467.52	J/mol×K	752.85	Joback Calculated Property
Cp,gas	474.85	J/mol×K	784.77	Joback Calculated Property
Cp,gas	481.57	J/mol×K	816.69	Joback Calculated Property
Cp,gas	487.71	J/mol×K	848.61	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,2,2-Trifluoro-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]acetamide.

Sources

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

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