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CAS 1559064-15-1

:

1-(Difluoromethyl)-1H-pyrrole-2-carbonitrile

Description:
1-(Difluoromethyl)-1H-pyrrole-2-carbonitrile is a chemical compound characterized by its unique structure, which includes a pyrrole ring substituted with a difluoromethyl group and a cyano group. The presence of the difluoromethyl group imparts notable electronic and steric properties, making it of interest in various chemical applications, particularly in medicinal chemistry and agrochemicals. The cyano group contributes to the compound's reactivity, allowing for potential participation in nucleophilic addition reactions. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its molecular structure suggests potential for diverse interactions, which can be exploited in the synthesis of more complex molecules. Additionally, the presence of fluorine atoms often enhances metabolic stability and lipophilicity, which are desirable traits in drug development. Safety and handling precautions should be observed, as with many fluorinated compounds, due to potential toxicity and environmental concerns. Overall, 1-(Difluoromethyl)-1H-pyrrole-2-carbonitrile represents a valuable building block in synthetic organic chemistry.
Formula:C6H4F2N2
InChI:InChI=1S/C6H4F2N2/c7-6(8)10-3-1-2-5(10)4-9/h1-3,6H
InChI key:InChIKey=AHAODOYDGQCJAQ-UHFFFAOYSA-N
SMILES:C(#N)C=1N(C(F)F)C=CC1
Synonyms:
  • 1-(Difluoromethyl)-1H-pyrrole-2-carbonitrile
  • 1H-Pyrrole-2-carbonitrile, 1-(difluoromethyl)-
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