1-Benzyl-2,1-benzothiazole-3(1H)-thione

Base Information

• Chemical Name: 1-Benzyl-2,1-benzothiazole-3(1H)-thione
• CAS No.: 111865-11-3
• Molecular Formula: C₁₄H₁₁NS₂
• Molecular Weight: 257.38
• DSSTox Substance ID: DTXSID10551553
• Wikidata: Q82431271
• Mol file: 111865-11-3.mol

Synonyms:111865-11-3;1-Benzyl-2,1-benzothiazole-3(1H)-thione;DTXSID10551553

Chemical Property of 1-Benzyl-2,1-benzothiazole-3(1H)-thione

Chemical Property:

• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 257.03329170
• Heavy Atom Count: 17
• Complexity: 286

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=S)S2

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