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CAS 175137-59-4

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4-Bromo-3,5-dimethyl-1H-pyrazole-1-acetonitrile

Description:
4-Bromo-3,5-dimethyl-1H-pyrazole-1-acetonitrile is an organic compound characterized by its pyrazole ring structure, which is a five-membered ring containing two nitrogen atoms. The presence of bromine and two methyl groups at the 3 and 5 positions of the pyrazole ring contributes to its unique chemical properties. The acetonitrile functional group attached at the 1-position enhances its reactivity and solubility in polar solvents. This compound is typically used in synthetic organic chemistry, particularly in the development of pharmaceuticals and agrochemicals, due to its ability to act as a building block in various chemical reactions. It may exhibit biological activity, making it of interest in medicinal chemistry. The compound's physical properties, such as melting point, boiling point, and solubility, can vary based on environmental conditions and purity. Safety data should be consulted, as halogenated compounds can pose health risks, and appropriate handling procedures should be followed in laboratory settings.
Formula:C7H8BrN3
InChI:InChI=1S/C7H8BrN3/c1-5-7(8)6(2)11(10-5)4-3-9/h4H2,1-2H3
InChI key:InChIKey=QQTALTIGHKIMSM-UHFFFAOYSA-N
SMILES:C(C#N)N1C(C)=C(Br)C(C)=N1
Synonyms:
  • (4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)acetonitrile
  • 1H-Pyrazole-1-acetonitrile, 4-bromo-3,5-dimethyl-
  • 2-(4-Bromo-3,5-dimethylpyrazol-1-yl)acetonitrile
  • 4-Bromo-3,5-dimethyl-1H-pyrazole-1-acetonitrile
  • 2-(4-Bromo-3,5-dimethyl-1H-pyrazol-1-yl)acetonitrile
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