Cas no 1214332-43-0 (Methyl 5-fluoro-2-oxo-1,2-dihydropyridine-3-carboxylate)

Methyl 5-fluoro-2-oxo-1,2-dihydropyridine-3-carboxylate structure
1214332-43-0 structure
Product Name:Methyl 5-fluoro-2-oxo-1,2-dihydropyridine-3-carboxylate
CAS No:1214332-43-0
MF:C7H6FNO3
MW:171.125845432281
CID:4726726
Update Time:2023-08-16

Methyl 5-fluoro-2-oxo-1,2-dihydropyridine-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 5-fluoro-2-hydroxynicotinate
    • Methyl 5-fluoro-2-oxo-1,2-dihydropyridine-3-carboxylate
    • Inchi: 1S/C7H6FNO3/c1-12-7(11)5-2-4(8)3-9-6(5)10/h2-3H,1H3,(H,9,10)
    • InChI Key: HQKZCWTVJUJYQO-UHFFFAOYSA-N
    • SMILES: FC1=CNC(C(C(=O)OC)=C1)=O

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 293
  • Topological Polar Surface Area: 55.4
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