3-Diazonio-4-oxo-4H-1-benzothiopyran-2-olate

Base Information

• Chemical Name: 3-Diazonio-4-oxo-4H-1-benzothiopyran-2-olate
• CAS No.: 61424-03-1
• Molecular Formula: C9H4N2O2S
• DSSTox Substance ID: DTXSID60492366
• Wikidata: Q82338200

Synonyms:61424-03-1;3-Diazonio-4-oxo-4H-1-benzothiopyran-2-olate;DTXSID60492366

Chemical Property of 3-Diazonio-4-oxo-4H-1-benzothiopyran-2-olate

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 203.99934855
• Heavy Atom Count: 14
• Complexity: 355

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=O)C(=C(S2)[O-])[N+]#N

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