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CAS 1310379-49-7

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4-Chloro-1-methyl-1H-pyrazole-5-acetonitrile

Description:
4-Chloro-1-methyl-1H-pyrazole-5-acetonitrile is a chemical compound characterized by its pyrazole ring structure, which is a five-membered ring containing two nitrogen atoms. The presence of a chloro group at the 4-position and a methyl group at the 1-position contributes to its unique reactivity and properties. The acetonitrile functional group at the 5-position enhances its potential as a building block in organic synthesis and medicinal chemistry. This compound is typically a solid at room temperature and may exhibit moderate solubility in polar organic solvents. Its chemical properties include potential nucleophilicity and electrophilicity due to the functional groups present, making it useful in various chemical reactions, including substitution and coupling reactions. Additionally, the presence of the cyano group may impart specific biological activities, making it of interest in pharmaceutical research. Safety data should be consulted for handling, as halogenated compounds can pose health risks. Overall, 4-Chloro-1-methyl-1H-pyrazole-5-acetonitrile is a versatile compound with applications in synthetic chemistry and drug development.
Formula:C6H6ClN3
InChI:InChI=1S/C6H6ClN3/c1-10-6(2-3-8)5(7)4-9-10/h4H,2H2,1H3
InChI key:InChIKey=RYQYFRNFBPOQFL-UHFFFAOYSA-N
SMILES:C(C#N)C1=C(Cl)C=NN1C
Synonyms:
  • 1H-Pyrazole-5-acetonitrile, 4-chloro-1-methyl-
  • 4-Chloro-1-methyl-1H-pyrazole-5-acetonitrile
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