3-Bromobenzo[c]isothiazole

Base Information

• Chemical Name: 3-Bromobenzo[c]isothiazole
• CAS No.: 34250-63-0
• Molecular Formula: C₇H₄BrNS
• Molecular Weight: 214.085
• European Community (EC) Number: 861-648-5
• DSSTox Substance ID: DTXSID60605878
• Wikidata: Q82504305
• Mol file: 34250-63-0.mol

Synonyms:3-Bromobenzo[c]isothiazole;34250-63-0;3-bromo-2,1-benzothiazole;SCHEMBL5571932;DTXSID60605878;AKOS015151738;CS-0216173;EN300-3571401

Chemical Property of 3-Bromobenzo[c]isothiazole

Chemical Property:

• Vapor Pressure: 0.00503mmHg at 25°C
• Storage Temp.: 2-8°C
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 212.92478
• Heavy Atom Count: 10
• Complexity: 131

Purity/Quality:

99% ^*data from raw suppliers

3-bromobenzo[c]isothiazole 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC2=C(SN=C2C=C1)Br

Technology Process of 3-Bromobenzo[c]isothiazole

There total 1 articles about 3-Bromobenzo[c]isothiazole 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:

benzo[c]isothiazol-3-ylamine (2400-12-6) → 3-Brom-2,1-benzisothiazol (34250-63-0)

Guidance literature:

Multistep reaction; (i) aq. HBr, (ii) aq. NaNO₂, (iii) CuBr, aq. HCl;

upstream raw materials:

benzo[c]isothiazol-3-ylamine