Chemical Properties of Propanamide, N-(4-fluorophenyl)-3-phenyl-

InChI

InChI=1S/C15H14FNO/c16-13-7-9-14(10-8-13)17-15(18)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2,(H,17,18)

InChI Key

OIWMUPBNVSEYPP-UHFFFAOYSA-N

Formula

C15H14FNO

SMILES

O=C(CCc1ccccc1)Nc1ccc(F)cc1

Molecular Weight¹

243.28

• 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	0.6327		Relay (1.0) Calculated Property
ΔfG°	56.27	kJ/mol	Joback Calculated Property
ΔfH°gas	-216.03	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	32.08	kJ/mol	Joback Calculated Property
ΔvapH°	92.15	kJ/mol	Relay (1.0) Calculated Property
IE	8.26	eV	Relay (1.0) Calculated Property
log10WS	-3.72		Relay (1.0) Calculated Property
logPoct/wat	3.397		Crippen Calculated Property
McVol	188.010	ml/mol	McGowan Calculated Property
Pc	2550.76	kPa	Joback Calculated Property
Inp	[2069.00; 2069.00]
Inp	2069.00		NIST
Inp	2069.00		NIST
Tboil	612.89	K	Relay (1.0) Calculated Property
Tc	898.14	K	Relay (1.0) Calculated Property
Tfus	370.62	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	[499.89; 571.30]	J/mol×K	[704.25; 933.27]
Cp,gas	499.89	J/mol×K	704.25	Joback Calculated Property
Cp,gas	514.39	J/mol×K	742.42	Joback Calculated Property
Cp,gas	527.76	J/mol×K	780.59	Joback Calculated Property
Cp,gas	540.07	J/mol×K	818.76	Joback Calculated Property
Cp,gas	551.38	J/mol×K	856.93	Joback Calculated Property
Cp,gas	561.77	J/mol×K	895.10	Joback Calculated Property
Cp,gas	571.30	J/mol×K	933.27	Joback Calculated Property

Similar Compounds

Find more compounds similar to Propanamide, N-(4-fluorophenyl)-3-phenyl-.

Sources

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

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