3-Iodobenzenesulfonamide

Base Information

• Chemical Name: 3-Iodobenzenesulfonamide
• CAS No.: 50702-39-1
• Molecular Formula: C6H6INO2S
• Molecular Weight: 283.09
• Hs Code.: 2935009090
• European Community (EC) Number: 852-659-6
• DSSTox Substance ID: DTXSID20459197
• Nikkaji Number: J409.565K
• Mol file: 50702-39-1.mol

Synonyms:3-iodobenzenesulfonamide;3-iodobenzene-1-sulfonamide;50702-39-1;3-iodobenzene sulphonamide;SCHEMBL3919478;DTXSID20459197;VDQBCIQHOXPLFI-UHFFFAOYSA-N;AKOS009345953;AS-58278;CS-0257199;EN300-66489;D85694;Z385450656

Chemical Property of 3-Iodobenzenesulfonamide

Chemical Property:

• PSA: 68.54000
• LogP: 2.71970
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 282.91640
• Heavy Atom Count: 11
• Complexity: 221

Purity/Quality:

99% ^*data from raw suppliers

3-IODOBENZENE-1-SULFONAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 3-Iodobenzenesulfonamide

There total 2 articles about 3-Iodobenzenesulfonamide 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: 79.0%

benzenesulfonamide (98-10-2) → 3-iodobenzenesulfonamide (50702-39-1)

Guidance literature:

With sodium iodate; iodine; In sulfuric acid; at 25 - 30 ℃; for 1h;

DOI:10.1016/j.tet.2004.07.095

Reference yield:

→ 3-iodobenzenesulfonamide (50702-39-1)

Guidance literature:

3-Iodbenzolsulfonsaeure (ueber das Saeurechlorid), NH4OH;

DOI:10.1002/jlcr.2590090207

Reference yield: 98.0%

3-iodobenzenesulfonamide (50702-39-1) + N,N-dimethyl-formamide dimethyl acetal (4637-24-5) → N-[(dimethylamino)methylidene]-3-iodobenzenesulfonamide (1383120-68-0)

Guidance literature:

In neat (no solvent); at 20 ℃; for 0.25h; under 760.051 Torr; Green chemistry;

DOI:10.1039/c3gc40797g

upstream raw materials:

benzenesulfonamide

Downstream raw materials:

3-(4-{[6-(benzyl{(2R)-2-[4-(benzyloxy)-3-(formylamino)phenyl]-2-hydroxyethyl}amino)hexyl]oxy}but-1-ynyl)benzenesulfonamide

3-[4-({6-[(5R)-5-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-oxo-1,3-oxazolidin-3-yl]hexyl}oxy)but-1-ynyl]benzenesulfonamide

3-[3-({7-[(5R)-5-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-oxo-1,3-oxazolidin-3-yl]heptyl}oxy)prop-1-ynyl]benzenesulfonamide

3-[5-({5-[(5R)-5-(2,2-dimethyl-4H-1,3-benzodioxin-6-yl)-2-oxo-1,3-oxazolidin-3-yl]pentyl}oxy)pent-1-ynyl]benzenesulfonamide

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