1,3,5-Tribromo-2-[(oxo-lambda~4~-sulfanylidene)amino]benzene

Base Information

• Chemical Name: 1,3,5-Tribromo-2-[(oxo-lambda~4~-sulfanylidene)amino]benzene
• CAS No.: 100191-23-9
• Molecular Formula: C6H2Br3NOS
• Molecular Weight: 375.866
• DSSTox Substance ID: DTXSID80573621
• Wikidata: Q82462396
• Mol file: 100191-23-9.mol

Synonyms:100191-23-9;1,3,5-Tribromo-2-[(oxo-lambda~4~-sulfanylidene)amino]benzene;1,3,5-tribromo-2-(sulfinylamino)benzene;SCHEMBL6938857;DTXSID80573621

Chemical Property of 1,3,5-Tribromo-2-[(oxo-lambda~4~-sulfanylidene)amino]benzene

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 374.73867
• Heavy Atom Count: 12
• Complexity: 197

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1Br)N=S=O)Br)Br

Technology Process of 1,3,5-Tribromo-2-[(oxo-lambda~4~-sulfanylidene)amino]benzene

There total 1 articles about 1,3,5-Tribromo-2-[(oxo-lambda~4~-sulfanylidene)amino]benzene 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:

2,4,6-tribromoaniline (147-82-0) → N?sulfinyl?2,4,6?tribromoaniline (100191-23-9)

Guidance literature:

With thionyl chloride; benzene;

Reference yield: 96.0%

9-fluorenone (486-25-9,952573-42-1) + N?sulfinyl?2,4,6?tribromoaniline (100191-23-9) → N-(2,4,6-tribromophenyl)fluorenimine (1444266-92-5)

Guidance literature:

With Ta(N^tBu)(CH₂CMe₂Ph)₃/SiO₂; In n-heptane; for 3h; Inert atmosphere; Schlenk technique; Reflux;

DOI:10.1021/om4001499

Reference yield: 77.0%

N?sulfinyl?2,4,6?tribromoaniline (100191-23-9) + benzaldehyde (100-52-7) → 2,4,6-tribromo-N-benzylideneaniline (56827-88-4)

Guidance literature:

molybdenium(VI) dioxodichloride; In toluene; for 8h; Heating;

DOI:10.1016/j.tetlet.2007.11.131

upstream raw materials:

2,4,6-tribromoaniline

Downstream raw materials:

2,4,6-tribromo-N-benzylideneaniline

C₁₆H₁₄Br₃N

N-(2,4,6-tribromophenyl)fluorenimine