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CAS 213990-58-0

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3-Pyridinecarbonitrile, 5-fluoro-1,2-dihydro-6-hydroxy-2-oxo-, sodium salt (1:1)

Description:
3-Pyridinecarbonitrile, 5-fluoro-1,2-dihydro-6-hydroxy-2-oxo-, sodium salt (1:1), with the CAS number 213990-58-0, is a chemical compound characterized by its pyridine ring structure, which is a six-membered aromatic ring containing one nitrogen atom. This compound features a cyano group (-C≡N) attached to the pyridine, contributing to its reactivity and potential applications in organic synthesis. The presence of a fluorine atom enhances its biological activity and lipophilicity, while the hydroxyl group (-OH) and carbonyl group (C=O) suggest potential for hydrogen bonding and reactivity in various chemical reactions. As a sodium salt, it is likely to be soluble in water, which can facilitate its use in biological or pharmaceutical contexts. The compound may exhibit interesting pharmacological properties, making it a subject of interest in medicinal chemistry. Overall, its unique functional groups and structural characteristics position it as a versatile compound in chemical research and applications.
Formula:C6H3FN2O2·Na
InChI:InChI=1S/C6H3FN2O2.Na/c7-4-1-3(2-8)5(10)9-6(4)11;/h1H,(H2,9,10,11);
InChI key:InChIKey=UBGXPHVRHNXODM-UHFFFAOYSA-N
SMILES:C(#N)C=1C(=O)NC(O)=C(F)C1.[Na]
Synonyms:
  • 3-Pyridinecarbonitrile, 5-fluoro-1,2-dihydro-6-hydroxy-2-oxo-, monosodium salt
  • 3-Pyridinecarbonitrile, 5-fluoro-1,2-dihydro-6-hydroxy-2-oxo-, sodium salt (1:1)
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