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

5-Fluoro-3-(tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione

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5-Fluoro-3-(tetrahydrofuran-2-yl)pyrimidine-2,4(1H,3H)-dione
Catalog OFC63901837
CAS 63901-83-7
Category Fluorinated Pyrimidines
Synonyms 3-(2-Tetrahydrofuryl)-5-fluorouracil
Purity 97%
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Other Identifiers Chemical Data Computational Chemistry
IUPAC Name 5-fluoro-3-(oxolan-2-yl)-1H-pyrimidine-2,4-dione
InChI InChI=1S/C8H9FN2O3/c9-5-4-10-8(13)11(7(5)12)6-2-1-3-14-6/h4,6H,1-3H2,(H,10,13)
InChI Key MGYWDJWGVICAEL-UHFFFAOYSA-N
Isomeric SMILES C1CC(OC1)N2C(=O)C(=CNC2=O)F
Molecular Formula C8H9FN2O3
Molecular Weight 200.17
XLogP3-AA 0
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 200.05972032 g/mol
Monoisotopic Mass 200.05972032 g/mol
Topological Polar Surface Area 58.6Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 316

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