Chemical Properties of N-(2,6-Diethylphenyl)-2,2,3,3,3-pentafluoropropanamide

InChI

InChI=1S/C13H14F5NO/c1-3-8-6-5-7-9(4-2)10(8)19-11(20)12(14,15)13(16,17)18/h5-7H,3-4H2,1-2H3,(H,19,20)

InChI Key

GLEAQAVYZLTCJB-UHFFFAOYSA-N

Formula

C13H14F5NO

SMILES

CCc1cccc(CC)c1NC(=O)C(F)(F)C(F)(F)F

Molecular Weight¹

295.25

Other Names

• 2-Pentafluoro-n-propionylamino-1,3-diethylbenzene
• 2,6-Diethylaniline, N-pentafluoropropionyl-

• 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	0.5989		Relay (1.0) Calculated Property
ΔfG°	-856.17	kJ/mol	Joback Calculated Property
ΔfH°gas	-1262.30	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	29.96	kJ/mol	Joback Calculated Property
ΔvapH°	74.76	kJ/mol	Relay (1.0) Calculated Property
IE	8.79	eV	Relay (1.0) Calculated Property
log10WS	-4.32		Relay (1.0) Calculated Property
logPoct/wat	3.948		Crippen Calculated Property
McVol	190.670	ml/mol	McGowan Calculated Property
Pc	1930.44	kPa	Joback Calculated Property
Inp	[1354.00; 1354.00]
Inp	1354.00		NIST
Inp	1354.00		NIST
Tboil	505.48	K	Relay (1.0) Calculated Property
Tc	688.80	K	Relay (1.0) Calculated Property
Tfus	326.53	K	Relay (1.0) Calculated Property
Vc	0.678	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[516.04; 583.83]	J/mol×K	[627.41; 813.12]
Cp,gas	516.04	J/mol×K	627.41	Joback Calculated Property
Cp,gas	529.36	J/mol×K	658.36	Joback Calculated Property
Cp,gas	541.80	J/mol×K	689.31	Joback Calculated Property
Cp,gas	553.42	J/mol×K	720.27	Joback Calculated Property
Cp,gas	564.26	J/mol×K	751.22	Joback Calculated Property
Cp,gas	574.38	J/mol×K	782.17	Joback Calculated Property
Cp,gas	583.83	J/mol×K	813.12	Joback Calculated Property

Similar Compounds

Find more compounds similar to N-(2,6-Diethylphenyl)-2,2,3,3,3-pentafluoropropanamide.

Sources

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

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