3-Nitrocinnoline-4-carbonitrile

Base Information

• Chemical Name: 3-Nitrocinnoline-4-carbonitrile
• CAS No.: 87953-99-9
• Molecular Formula: C₉H₄N₄O₂
• Molecular Weight: 200.156
• DSSTox Substance ID: DTXSID50351958
• Wikidata: Q82128813

Synonyms:3-nitrocinnoline-4-carbonitrile;87953-99-9;DTXSID50351958;ZB1208;AKOS001729403

Chemical Property of 3-Nitrocinnoline-4-carbonitrile

Chemical Property:

• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 200.03342538
• Heavy Atom Count: 15
• Complexity: 305

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=C(N=N2)[N+](=O)[O-])C#N

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