Organofluorine / Alfa Chemistry
5-Fluoro-1-picolinoylpyrimidine-2,4(1H,3H)-dione

5-Fluoro-1-picolinoylpyrimidine-2,4(1H,3H)-dione

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5-Fluoro-1-picolinoylpyrimidine-2,4(1H,3H)-dione
Catalog OFC88740572
CAS 88740-57-2
Category Fluorinated Pyrimidines
Synonyms 5-Fluoro-1-(pyridine-2-carbonyl)pyrimidine-2,4(1H,3H)-dione
Purity 97%
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 5-fluoro-1-(pyridine-2-carbonyl)pyrimidine-2,4-dione
InChI InChI=1S/C10H6FN3O3/c11-6-5-14(10(17)13-8(6)15)9(16)7-3-1-2-4-12-7/h1-5H,(H,13,15,17)
InChI Key GFAMMSVQPUGGPG-UHFFFAOYSA-N
Isomeric SMILES C1=CC=NC(=C1)C(=O)N2C=C(C(=O)NC2=O)F
Molecular Formula C10H6FN3O3
Molecular Weight 235.17
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 235.03931922 g/mol
Monoisotopic Mass 235.03931922 g/mol
Topological Polar Surface Area 79.4Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 408

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