Chemical Properties of Benzamide, N-(2-iodo-4-methylphenyl)-2-fluoro-

InChI

InChI=1S/C14H11FINO/c1-9-6-7-13(12(16)8-9)17-14(18)10-4-2-3-5-11(10)15/h2-8H,1H3,(H,17,18)

InChI Key

KXOHOUGEPPKILF-UHFFFAOYSA-N

Formula

C14H11FINO

SMILES

Cc1ccc(NC(=O)c2ccccc2F)c(I)c1

Molecular Weight¹

355.15

• 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	0.6180		Relay (1.0) Calculated Property
ΔfG°	86.71	kJ/mol	Joback Calculated Property
ΔfH°gas	-121.62	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	33.12	kJ/mol	Joback Calculated Property
ΔvapH°	98.51	kJ/mol	Relay (1.0) Calculated Property
IE	8.02	eV	Relay (1.0) Calculated Property
log10WS	-4.97		Relay (1.0) Calculated Property
logPoct/wat	3.991		Crippen Calculated Property
McVol	199.740	ml/mol	McGowan Calculated Property
Pc	2668.02	kPa	Joback Calculated Property
Inp	[2376.00; 2376.00]
Inp	2376.00		NIST
Inp	2376.00		NIST
Tboil	636.43	K	Relay (1.0) Calculated Property
Tc	956.74	K	Relay (1.0) Calculated Property
Tfus	426.08	K	Relay (1.0) Calculated Property
Vc	0.683	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[488.36; 544.91]	J/mol×K	[784.47; 1042.85]
Cp,gas	488.36	J/mol×K	784.47	Joback Calculated Property
Cp,gas	500.13	J/mol×K	827.53	Joback Calculated Property
Cp,gas	510.84	J/mol×K	870.60	Joback Calculated Property
Cp,gas	520.59	J/mol×K	913.66	Joback Calculated Property
Cp,gas	529.46	J/mol×K	956.72	Joback Calculated Property
Cp,gas	537.54	J/mol×K	999.78	Joback Calculated Property
Cp,gas	544.91	J/mol×K	1042.85	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, N-(2-iodo-4-methylphenyl)-2-fluoro-.

Sources

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

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