4-Bromo-N-(4-bromobenzene-1-sulfonyl)benzene-1-sulfonamide

Base Information

• Chemical Name: 4-Bromo-N-(4-bromobenzene-1-sulfonyl)benzene-1-sulfonamide
• CAS No.: 1156-18-9
• Molecular Formula: C12H9Br2NO4S2
• Molecular Weight: 455.148
• DSSTox Substance ID: DTXSID70515010
• Nikkaji Number: J1.393.252B
• Wikidata: Q82375663
• Mol file: 1156-18-9.mol

Synonyms:1156-18-9;SCHEMBL10005288;DTXSID70515010;4-Bromo-N-(4-bromobenzene-1-sulfonyl)benzene-1-sulfonamide

Chemical Property of 4-Bromo-N-(4-bromobenzene-1-sulfonyl)benzene-1-sulfonamide

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 454.83193
• Heavy Atom Count: 21
• Complexity: 487

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1S(=O)(=O)NS(=O)(=O)C2=CC=C(C=C2)Br)Br

Technology Process of 4-Bromo-N-(4-bromobenzene-1-sulfonyl)benzene-1-sulfonamide

There total 4 articles about 4-Bromo-N-(4-bromobenzene-1-sulfonyl)benzene-1-sulfonamide 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: 69.0%

4-bromo-benzenesulfonic acid amide (701-34-8) + 4-bromobenzenesulfonyl chloride (98-58-8) → di(4-bromobenzenesulfonyl)amine (1156-18-9)

Guidance literature:

With hydroxide; at 75 - 80 ℃;

DOI:10.1135/cccc19961205

Reference yield:

bromobenzene (108-86-1,52753-63-6) → di(4-bromobenzenesulfonyl)amine (1156-18-9)

Guidance literature:

Multi-step reaction with 2 steps

1: 94 percent / ClSO₃H

2: 69 percent / OH^- / 75 - 80 °C

With chlorosulfonic acid; hydroxide;

DOI:10.1135/cccc19961205

Reference yield:

4-bromobenzenesulfonyl chloride (98-58-8) → di(4-bromobenzenesulfonyl)amine (1156-18-9)

Guidance literature:

Multi-step reaction with 2 steps

1: 74 percent / ammonia

2: 69 percent / OH^- / 75 - 80 °C

With ammonia; hydroxide;

DOI:10.1135/cccc19961205

upstream raw materials:

4-bromo-benzenesulfonic acid amide

4-bromobenzenesulfonyl chloride

bromobenzene

Downstream raw materials:

silver(I) di(4-bromobenzenesulfonyl)amide*H₂O

3-bromoanilinium di(4-bromobenzenesulfonyl)amide

4-bromoanilinium di(4-bromobenzenesulfonyl)amide

C₅H₁₂N₂O*C₁₂H₉Br₂NO₄S₂