2'-Deoxy-5-Fluoro-5'-O-Nitrouridine

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Properties Simple | Detailed

Formula C9H10FN3O7
IUPAC Name [(2r,3s,5r)-5-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl nitrate
Molecular Mass 291.190 g·mol−1
Heat of Formation -367.7 ± 16.7 kJ·mol−1
Dipole Moment 1.58 ± 1.08 D
Volume 283.08 Å 3
Surface Area 281.41 Å 2
HOMO Energy -10.45 ± 0.55 eV
LUMO Energy -2.06 ± eV
Point Group Symmetry C1
Synonyms
  • 5-fluoro-5'-o-nitro-2'-deoxyuridine
  • [(2r,3s,5r)-5-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-3-hydroxy-oxolan-2-yl]methyl nitrate
  • [(2r,3s,5r)-5-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl nitrate
  • [(2r,3s,5r)-5-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl nitrate
  • fdumn
  • nitric acid [(2r,3s,5r)-5-(5-fluoro-2,4-diketo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl ester
  • nitric acid [(2r,3s,5r)-5-(5-fluoro-2,4-dioxo-1-pyrimidinyl)-3-hydroxy-2-tetrahydrofuranyl]methyl ester
  • uridine, 2'-deoxy-5-fluoro-, 5'-nitrate
CAS Number(s)
  • 77421-85-3
InChIKey FUMAOUACDCPWNK-RRKCRQDMSA-N
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