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CAS 91591-64-9

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2-Chloro-4,5,6-trimethyl-3-pyridinecarbonitrile

Description:
2-Chloro-4,5,6-trimethyl-3-pyridinecarbonitrile, with the CAS number 91591-64-9, is an organic compound characterized by its pyridine ring structure, which is a six-membered aromatic ring containing one nitrogen atom. This compound features a chloro substituent and three methyl groups at the 4, 5, and 6 positions of the pyridine ring, along with a cyano group (-C≡N) at the 3-position. The presence of these functional groups contributes to its chemical reactivity and potential applications in various fields, including pharmaceuticals and agrochemicals. The chloro group can participate in nucleophilic substitution reactions, while the cyano group can serve as a versatile building block in organic synthesis. The compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its specific physical properties, such as melting point and boiling point, would depend on the molecular interactions and the purity of the sample. Safety data should be consulted for handling and storage, as halogenated compounds can pose health and environmental risks.
Formula:C9H9ClN2
InChI:InChI=1S/C9H9ClN2/c1-5-6(2)8(4-11)9(10)12-7(5)3/h1-3H3
InChI key:InChIKey=OPJDHHFDFUSYCZ-UHFFFAOYSA-N
SMILES:C(#N)C=1C(C)=C(C)C(C)=NC1Cl
Synonyms:
  • 2-Chloro-4,5,6-trimethyl-3-pyridinecarbonitrile
  • 2-Chloro-4,5,6-trimethylnicotinonitrile
  • 3-Pyridinecarbonitrile, 2-chloro-4,5,6-trimethyl-
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