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CAS 32183-13-4

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1,3-Dimethyl-4-nitro-1H-pyrazole-5-carbonitrile

Description:
1,3-Dimethyl-4-nitro-1H-pyrazole-5-carbonitrile is an organic compound characterized by its pyrazole ring structure, which is a five-membered ring containing two nitrogen atoms. This compound features a nitro group (-NO2) and a cyano group (-C≡N) attached to the pyrazole ring, contributing to its reactivity and potential applications in various chemical processes. The presence of two methyl groups at the 1 and 3 positions of the pyrazole enhances its lipophilicity and may influence its biological activity. The compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its unique structure makes it of interest in medicinal chemistry and agrochemical research, where it may serve as a precursor or intermediate in the synthesis of more complex molecules. Safety data should be consulted for handling, as compounds with nitro and cyano functionalities can pose health risks. Overall, 1,3-Dimethyl-4-nitro-1H-pyrazole-5-carbonitrile is a versatile compound with potential applications in various fields of chemistry.
Formula:C6H6N4O2
InChI:InChI=1S/C6H6N4O2/c1-4-6(10(11)12)5(3-7)9(2)8-4/h1-2H3
InChI key:InChIKey=HYSDHMFCQHHFGV-UHFFFAOYSA-N
SMILES:N(=O)(=O)C1=C(C#N)N(C)N=C1C
Synonyms:
  • Pyrazole-5-carbonitrile, 1,3-dimethyl-4-nitro-
  • 5-Cyano-1,3-dimethyl-4-nitropyrazole
  • 1,3-Dimethyl-5-cyano-4-nitropyrazole
  • 1H-Pyrazole-5-carbonitrile, 1,3-dimethyl-4-nitro-
  • 1,3-Dimethyl-4-nitro-1H-pyrazole-5-carbonitrile
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