3H-1-Benzothiepin-1-ium

Base Information

• Chemical Name: 3H-1-Benzothiepin-1-ium
• CAS No.: 92540-75-5
• Molecular Formula: C10H9S
• DSSTox Substance ID: DTXSID80534797

Synonyms:3H-1-Benzothiepin-1-ium;92540-75-5;DTXSID80534797

Chemical Property of 3H-1-Benzothiepin-1-ium

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 161.04249646
• Heavy Atom Count: 11
• Complexity: 181

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C=CC2=CC=CC=C2[S+]=C1

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