3,3-Dibromo-2-oxo-2,3-dihydro-1H-indole-5-carbonitrile

Base Information

• Chemical Name: 3,3-Dibromo-2-oxo-2,3-dihydro-1H-indole-5-carbonitrile
• CAS No.: 113423-49-7
• Molecular Formula: C₉H₄Br₂N₂O
• Molecular Weight: 315.952
• DSSTox Substance ID: DTXSID601211252
• Mol file: 113423-49-7.mol

Synonyms:113423-49-7;SCHEMBL7371913;3,3-Dibromo-2-oxo-2,3-dihydro-1H-indole-5-carbonitrile;RJLRKPYMJFXWNS-UHFFFAOYSA-N;DTXSID601211252;3,3-Dibromo-2,3-dihydro-2-oxo-1H-indole-5-carbonitrile

Chemical Property of 3,3-Dibromo-2-oxo-2,3-dihydro-1H-indole-5-carbonitrile

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 315.86699
• Heavy Atom Count: 14
• Complexity: 320

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C1C#N)C(C(=O)N2)(Br)Br

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