S-(6-Methyl-1,3-benzothiazol-2-yl) benzenesulfonothioate

Base Information

• Chemical Name: S-(6-Methyl-1,3-benzothiazol-2-yl) benzenesulfonothioate
• CAS No.: 97479-98-6
• Molecular Formula: C14H11NO2S3
• DSSTox Substance ID: DTXSID50602917
• Wikidata: Q82500124

Synonyms:97479-98-6;SCHEMBL10670756;DTXSID50602917;S-(6-Methyl-1,3-benzothiazol-2-yl) benzenesulfonothioate

Chemical Property of S-(6-Methyl-1,3-benzothiazol-2-yl) benzenesulfonothioate

Chemical Property:

• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 320.99519211
• Heavy Atom Count: 20
• Complexity: 428

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1)N=C(S2)SS(=O)(=O)C3=CC=CC=C3

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