Chemical Properties of Acetanilide, 3-trifluoromethyl, acetoxy-M

InChI

InChI=1S/C11H10F3NO3/c1-6(16)15-8-3-4-10(18-7(2)17)9(5-8)11(12,13)14/h3-5H,1-2H3,(H,15,16)

InChI Key

MCLKOUJVUAKQDM-UHFFFAOYSA-N

Formula

C11H10F3NO3

SMILES

CC(=O)Nc1ccc(OC(C)=O)c(C(F)(F)F)c1

Molecular Weight¹

261.20

• 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°	-720.15	kJ/mol	Joback Calculated Property
ΔfH°gas	-957.77	kJ/mol	Joback Calculated Property
ΔfusH°	28.82	kJ/mol	Joback Calculated Property
ΔvapH°	62.27	kJ/mol	Joback Calculated Property
log10WS	-3.09		Crippen Calculated Property
logPoct/wat	2.589		Crippen Calculated Property
McVol	166.390	ml/mol	McGowan Calculated Property
Pc	2584.59	kPa	Joback Calculated Property
Inp	[1840.00; 1840.00]
Inp	1840.00		NIST
Inp	1840.00		NIST
Tboil	662.63	K	Joback Calculated Property
Tc	864.59	K	Joback Calculated Property
Tfus	444.13	K	Joback Calculated Property
Vc	0.651	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[437.65; 493.75]	J/mol×K	[662.63; 864.59]
Cp,gas	437.65	J/mol×K	662.63	Joback Calculated Property
Cp,gas	448.82	J/mol×K	696.29	Joback Calculated Property
Cp,gas	459.23	J/mol×K	729.95	Joback Calculated Property
Cp,gas	468.90	J/mol×K	763.61	Joback Calculated Property
Cp,gas	477.86	J/mol×K	797.27	Joback Calculated Property
Cp,gas	486.13	J/mol×K	830.93	Joback Calculated Property
Cp,gas	493.75	J/mol×K	864.59	Joback Calculated Property

Similar Compounds

Find more compounds similar to Acetanilide, 3-trifluoromethyl, acetoxy-M.

Sources

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

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