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CAS 194490-14-7

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5-Chloro-1H-indole-3-carbonitrile

Description:
5-Chloro-1H-indole-3-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 chlorine atom at the 5-position and a cyano group (-C≡N) at the 3-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 medicinal chemistry and research due to its potential biological activities, including antimicrobial and anticancer properties. The cyano group can participate in various chemical reactions, making it a versatile intermediate in organic synthesis. Safety data indicates that, like many halogenated compounds, it should be handled with care, as it may pose health risks upon exposure. Overall, 5-Chloro-1H-indole-3-carbonitrile is a valuable compound in the field of organic chemistry and drug development.
Formula:C9H5ClN2
InChI:InChI=1S/C9H5ClN2/c10-7-1-2-9-8(3-7)6(4-11)5-12-9/h1-3,5,12H
InChI key:InChIKey=KQMMMHWMPSFPSP-UHFFFAOYSA-N
SMILES:C(#N)C=1C=2C(NC1)=CC=C(Cl)C2
Synonyms:
  • 1H-Indole-3-carbonitrile, 5-chloro-
  • 5-Chloro-1H-Indole-3-Carbonitrile5-Chloro-3-Cyanoindole
  • 5-chloro -1H-indole-3-carbonitrile
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