2-iodo-N-(4-methylphenyl)benzamide

Base Information

• Chemical Name: 2-iodo-N-(4-methylphenyl)benzamide
• CAS No.: 62303-05-3
• Molecular Formula: C14H12INO
• Molecular Weight: 337.16
• DSSTox Substance ID: DTXSID90354463
• Nikkaji Number: J937.479E
• Wikidata: Q82132628
• Mol file: 62303-05-3.mol

Synonyms:2-iodo-N-(4-methylphenyl)benzamide;62303-05-3;2-Iodo-N-(p-tolyl)benzamide;Benzamide, 2-iodo-N-(4-methylphenyl)-;Oprea1_631113;SCHEMBL11590379;DTXSID90354463;AKOS001604774;CS-0365089;AG-205/04698061;SR-01000414646;SR-01000414646-1

Chemical Property of 2-iodo-N-(4-methylphenyl)benzamide

Chemical Property:

• Boiling Point: 339.0±35.0 °C(Predicted)
• PSA: 29.10000
• Density: 1.631±0.06 g/cm3(Predicted)
• LogP: 3.92490
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 336.99636
• Heavy Atom Count: 17
• Complexity: 261

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2I

Technology Process of 2-iodo-N-(4-methylphenyl)benzamide

There total 4 articles about 2-iodo-N-(4-methylphenyl)benzamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 94.0%

2-Iodobenzoyl chloride (609-67-6) + p-toluidine (106-49-0,12221-03-3) → 2-iodo-N-(p-tolyl)benzamide (62303-05-3)

Guidance literature:

With dmap; triethylamine; In dichloromethane; Inert atmosphere; Schlenk technique;

DOI:10.1039/c6dt01022a

Reference yield: 85.0%

2-Iodobenzoic acid (88-67-5) + p-toluidine (106-49-0,12221-03-3) → 2-iodo-N-(p-tolyl)benzamide (62303-05-3)

Guidance literature:

2-Iodobenzoic acid; With thionyl chloride; triethylamine; In dichloromethane; at 0 ℃; for 0.25h; Inert atmosphere;

p-toluidine; In dichloromethane; at 0 ℃; Inert atmosphere;

DOI:10.1002/adsc.201500642

Reference yield:

2-Iodobenzoic acid (88-67-5) → 2-iodo-N-(p-tolyl)benzamide (62303-05-3)

Guidance literature:

Multi-step reaction with 2 steps

1: PCl₅ / 2 h / 80 °C

2: benzene / cooling

With phosphorus pentachloride; In benzene;

DOI:10.1016/j.tet.2005.09.032

upstream raw materials:

2-Iodobenzoyl chloride

p-toluidine

2-Iodobenzoic acid

Downstream raw materials:

N-(4-methylphenyl)benzamide

(Z)-3-benzylidene-N-(4-methylphenyl)isoindolin-1-one

2-(2'-hydroxy-2'-methylpropynyl)-N-p-tolyl benzamide

2-iodo-N-p-tolyl-benzimidoyl chloride