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CAS 108161-13-3

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1H-Pyrazole-4-carbonitrile,1,3,5-trimethyl-(9CI)

Description:
1H-Pyrazole-4-carbonitrile, 1,3,5-trimethyl- (9CI), with the CAS number 108161-13-3, is an organic compound characterized by its pyrazole ring structure, which is a five-membered ring containing two nitrogen atoms. This compound features a carbonitrile functional group (-C≡N) at the 4-position of the pyrazole ring, contributing to its reactivity and potential applications in various chemical reactions. The presence of three methyl groups at the 1, 3, and 5 positions of the pyrazole ring enhances its lipophilicity and may influence its biological activity. Typically, compounds of this nature are of interest in medicinal chemistry and agrochemicals due to their potential pharmacological properties. The compound is likely to be a solid at room temperature and may exhibit moderate solubility in organic solvents. Its synthesis and reactivity can be explored in the context of heterocyclic chemistry, making it a valuable target for research in developing new materials or pharmaceuticals. Safety data should be consulted for handling and storage, as with all chemical substances.
Formula:C7H9N3
InChI:InChI=1/C7H9N3/c1-5-7(4-8)6(2)10(3)9-5/h1-3H3
SMILES:Cc1c(C#N)c(C)n(C)n1
Synonyms:
  • 1H-pyrazole-4-carbonitrile, 1,3,5-trimethyl-
  • 1,3,5-trimethyl-1H-pyrazole-4-carbonitrile
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