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CAS 902772-13-8

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5-Bromo-1H-indole-2-carbonitrile

Description:
5-Bromo-1H-indole-2-carbonitrile is a chemical compound characterized by its indole structure, which is a bicyclic compound consisting of a benzene ring fused to a pyrrole ring. The presence of a bromine atom at the 5-position and a cyano group (-C≡N) at the 2-position contributes to its unique reactivity and properties. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. It is often used in organic synthesis and medicinal chemistry, particularly in the development of pharmaceuticals due to its potential biological activity. The cyano group can participate in various chemical reactions, making it a versatile intermediate in synthetic pathways. Additionally, the bromine substituent can facilitate further functionalization through nucleophilic substitution reactions. Safety data should be consulted, as halogenated compounds can pose health risks, and appropriate handling procedures should be followed in laboratory settings. Overall, 5-Bromo-1H-indole-2-carbonitrile is a valuable compound in chemical research and development.
Formula:C9H5BrN2
InChI:InChI=1S/C9H5BrN2/c10-7-1-2-9-6(3-7)4-8(5-11)12-9/h1-4,12H
InChI key:InChIKey=PWYJCECTKKQOTQ-UHFFFAOYSA-N
SMILES:C(#N)C=1NC=2C(C1)=CC(Br)=CC2
Synonyms:
  • 5-Bromo-1H-indole-2-carbonitrile
  • 5-Bromoindole-2-carbonitrile
  • 1H-Indole-2-carbonitrile, 5-bromo-
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