4-(Thiophen-2-yl)-2H-1,3-dithiol-2-one

Base Information

• Chemical Name: 4-(Thiophen-2-yl)-2H-1,3-dithiol-2-one
• CAS No.: 76247-59-1
• Molecular Formula: C₇H₄OS₃
• Molecular Weight: 200.306
• DSSTox Substance ID: DTXSID60505687
• Nikkaji Number: J2.377.512C
• Wikidata: Q82360962

Synonyms:76247-59-1;4-(Thiophen-2-yl)-2H-1,3-dithiol-2-one;DTXSID60505687

Chemical Property of 4-(Thiophen-2-yl)-2H-1,3-dithiol-2-one

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 199.94242827
• Heavy Atom Count: 11
• Complexity: 212

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CSC(=C1)C2=CSC(=O)S2

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