6-nitro-1H-indole-3-carbonitrile

Base Information

• Chemical Name: 6-nitro-1H-indole-3-carbonitrile
• CAS No.: 4769-99-7
• Molecular Formula: C₉H₅N₃O₂
• Molecular Weight: 187.158
• DSSTox Substance ID: DTXSID10300543
• Nikkaji Number: J2.025.655I
• Wikidata: Q82043673
• Mol file: 4769-99-7.mol

Synonyms:6-nitro-1H-indole-3-carbonitrile;4769-99-7;3-cyano-6-nitroindole;SCHEMBL396951;DTXSID10300543;6-nitro-1 H-indole-3-carbonitrile;MFCD15527153;A1-08598

Chemical Property of 6-nitro-1H-indole-3-carbonitrile

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 187.038176411
• Heavy Atom Count: 14
• Complexity: 290

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1[N+](=O)[O-])NC=C2C#N