2-Thiabicyclo[3.2.0]hepta-1(5),3-diene

Base Information

• Chemical Name: 2-Thiabicyclo[3.2.0]hepta-1(5),3-diene
• CAS No.: 111999-57-6
• Molecular Formula: C6H6S
• DSSTox Substance ID: DTXSID40603110
• Wikidata: Q82500374
• Mol file: 111999-57-6.mol

Synonyms:2-Thiabicyclo[3.2.0]hepta-1(5),3-diene;111999-57-6;SCHEMBL562638;DTXSID40603110

Chemical Property of 2-Thiabicyclo[3.2.0]hepta-1(5),3-diene

Chemical Property:

• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 110.01902136
• Heavy Atom Count: 7
• Complexity: 80.2

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2=C1C=CS2

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