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CAS 306936-77-6

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1,3-Dimethyl-1H-pyrazole-5-carbonitrile

Description:
1,3-Dimethyl-1H-pyrazole-5-carbonitrile is an organic compound characterized by its pyrazole ring structure, which is a five-membered ring containing two nitrogen atoms. The compound features two methyl groups attached to the first carbon of the pyrazole ring and a cyano group (-C≡N) at the fifth position. This configuration contributes to its unique chemical properties, including its potential as a building block in organic synthesis and its applications in agrochemicals and pharmaceuticals. The presence of the cyano group enhances its reactivity, making it a useful intermediate in various chemical reactions. Additionally, the compound is typically a solid at room temperature and may exhibit moderate solubility in polar organic solvents. Its molecular structure allows for various functionalization possibilities, which can lead to the development of derivatives with tailored properties for specific applications. As with many nitrogen-containing heterocycles, it may also exhibit interesting biological activities, warranting further investigation in medicinal chemistry.
Formula:C6H7N3
InChI:InChI=1S/C6H7N3/c1-5-3-6(4-7)9(2)8-5/h3H,1-2H3
InChI key:InChIKey=FLBLWIMFXGNWRG-UHFFFAOYSA-N
SMILES:C(#N)C=1N(C)N=C(C)C1
Synonyms:
  • 1H-Pyrazole-5-carbonitrile, 1,3-dimethyl-
  • 2,5-Dimethyl-2H-pyrazole-3-carbonitrile
  • 2,5-Dimethylpyrazole-3-carbonitrile
  • 1,3-Dimethyl-1H-pyrazole-5-carbonitrile
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