Chemical Properties of Benzamide, N-(2-iodo-4-methylphenyl)-3-bromo-

InChI

InChI=1S/C14H11BrINO/c1-9-5-6-13(12(16)7-9)17-14(18)10-3-2-4-11(15)8-10/h2-8H,1H3,(H,17,18)

InChI Key

VQNZCBSMPFSSTN-UHFFFAOYSA-N

Formula

C14H11BrINO

SMILES

Cc1ccc(NC(=O)c2cccc(Br)c2)c(I)c1

Molecular Weight¹

416.05

• 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°	295.84	kJ/mol	Joback Calculated Property
ΔfH°gas	150.45	kJ/mol	Joback Calculated Property
ΔfusH°	35.32	kJ/mol	Joback Calculated Property
ΔvapH°	82.29	kJ/mol	Joback Calculated Property
log10WS	-6.23		Crippen Calculated Property
logPoct/wat	4.614		Crippen Calculated Property
McVol	215.470	ml/mol	McGowan Calculated Property
Pc	3012.33	kPa	Joback Calculated Property
Inp	[2732.00; 2732.00]
Inp	2732.00		NIST
Inp	2732.00		NIST
Tboil	851.36	K	Joback Calculated Property
Tc	1130.09	K	Joback Calculated Property
Tfus	558.39	K	Joback Calculated Property
Vc	0.794	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[508.48; 560.85]	J/mol×K	[851.36; 1130.09]
Cp,gas	508.48	J/mol×K	851.36	Joback Calculated Property
Cp,gas	519.21	J/mol×K	897.82	Joback Calculated Property
Cp,gas	528.97	J/mol×K	944.27	Joback Calculated Property
Cp,gas	537.89	J/mol×K	990.73	Joback Calculated Property
Cp,gas	546.09	J/mol×K	1037.18	Joback Calculated Property
Cp,gas	553.71	J/mol×K	1083.64	Joback Calculated Property
Cp,gas	560.85	J/mol×K	1130.09	Joback Calculated Property

Similar Compounds

Find more compounds similar to Benzamide, N-(2-iodo-4-methylphenyl)-3-bromo-.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.