3-Amino-6-methyl-4-oxo-4H-1-benzothiopyran-2-carbonitrile

Base Information

• Chemical Name: 3-Amino-6-methyl-4-oxo-4H-1-benzothiopyran-2-carbonitrile
• CAS No.: 61424-08-6
• Molecular Formula: C11H8N2OS
• DSSTox Substance ID: DTXSID40492369
• Wikidata: Q82338207

Synonyms:61424-08-6;DTXSID40492369;3-Amino-6-methyl-4-oxo-4H-1-benzothiopyran-2-carbonitrile

Chemical Property of 3-Amino-6-methyl-4-oxo-4H-1-benzothiopyran-2-carbonitrile

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 216.03573406
• Heavy Atom Count: 15
• Complexity: 379

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1)SC(=C(C2=O)N)C#N

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