2-Iodobenzamide

Base Information

• Chemical Name: 2-Iodobenzamide
• CAS No.: 3930-83-4
• Molecular Formula: C7H6INO
• Molecular Weight: 247.035
• Hs Code.: 2924299090
• NSC Number: 136970
• DSSTox Substance ID: DTXSID50192545
• Nikkaji Number: J213.068H
• Wikidata: Q83065222
• Mol file: 3930-83-4.mol

Synonyms:2-Iodobenzamide;3930-83-4;Benzamide, 2-iodo-;o-Iodobenzamide;Benzamide, o-iodo-;C7H6INO;BRN 2206530;MFCD00099248;0-09-00-00364 (Beilstein Handbook Reference);SCHEMBL967996;SCHEMBL8813905;2-iodo-benzamid;o-iodo-benzamid;DTXSID50192545;AMY28062;NSC136970;STL262834;TD1375;AKOS003635344;CS-W003984;NSC 136970;NSC-136970;2-Chloro-biphenyl-4-ylaminehydrochloride;AC-28493;AS-10322;LS-27049;SY013782;FT-0612663;I0734;EN300-60201;A824515;Z33546623

Chemical Property of 2-Iodobenzamide

Chemical Property:

• Vapor Pressure: 0.000278mmHg at 25°C
• Melting Point: 184 °C
• Refractive Index: 1.66
• Boiling Point: 322.518 °C at 760mmHg
• PKA: 15.46±0.50(Predicted)
• Flash Point: 148.854 °C
• PSA: 43.09000
• Density: 1.897 g/cm³
• LogP: 2.09040
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 246.94941
• Heavy Atom Count: 10
• Complexity: 138

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-Iodobenzamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C(=O)N)I

Technology Process of 2-Iodobenzamide

There total 20 articles about 2-Iodobenzamide 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: 98.0%

2-Iodobenzoic acid (88-67-5) → o-iodobenzamide (3930-83-4)

Guidance literature:

2-Iodobenzoic acid; With thionyl chloride; for 7h; Reflux;

With ammonia; at 0 ℃;

DOI:10.1021/acs.joc.9b00452

Reference yield: 90.0%

→ o-iodobenzamide (3930-83-4) + 4-methoxy-benzaldehyde (123-11-5)

Guidance literature:

With dipotassium peroxodisulfate; tris(2,2'-bipyridyl)ruthenium dichloride; In water; acetonitrile; at 20 ℃; for 12h; Irradiation;

Reference yield: 90.0%

N-(4-methoxybenzyl)-2-iodo-benzamide → o-iodobenzamide (3930-83-4)

Guidance literature:

With dipotassium peroxodisulfate; tris(bipyridine)ruthenium(II) dichloride hexahydrate; water; In acetonitrile; at 20 ℃; for 12h; Sealed tube; Irradiation; Green chemistry;

DOI:10.1002/adsc.201500257

upstream raw materials:

2-Iodobenzoyl chloride

2-Iodobenzoic acid

urea

anthranilic acid

Downstream raw materials:

2-iodobenzonitrile

bis(2-carboxamidophenyl) diselenide

methyl 2-[(2-carbamoylphenyl)ethynyl]benzoate

ethyl (2-hexanoylphenyl)carbamate

Refernces

• 1、 -. "Efficient nitriding reagent and application thereof". Paragraph 0309-0311. . Retrieved 2021/03/31.
• 2、 Jiao, Ning,Liu, Jianzhong,Qiu, Xu,Song, Song,Wei, Jialiang,Wen, Xiaojin,Zhang, Cheng,Zhang, Ziyao. "Nitromethane as a nitrogen donor in Schmidt-type formation of amides and nitriles". supporting information. p. 281 - 285. Retrieved 2020/01/28.