3-Methyl-1-benzothiophene-2-thiol

Base Information

• Chemical Name: 3-Methyl-1-benzothiophene-2-thiol
• CAS No.: 76354-66-0
• Molecular Formula: C9H8S2
• DSSTox Substance ID: DTXSID70514861
• Wikidata: Q82375416

Synonyms:3-Methyl-1-benzothiophene-2-thiol;76354-66-0;3-Methylbenzo[b]thiophene-2-thiol;3-methyl-2-benzothiophenethiol;SCHEMBL3093060;Methylbenzo[b]thiophene-2-thiol;DTXSID70514861;GZVJXAIRDSUFKQ-UHFFFAOYSA-N

Chemical Property of 3-Methyl-1-benzothiophene-2-thiol

Chemical Property:

• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 180.00674260
• Heavy Atom Count: 11
• Complexity: 147

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(SC2=CC=CC=C12)S

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