4-Amino-1-[2-Deoxy-2-(Fluoromethyl)-β-D-Arabinofuranosyl]-2(1H)-Pyrimidinone

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Formula C10H14FN3O4
IUPAC Name 4-amino-1-[(2r,3s,4s,5r)-3-(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one
Molecular Mass 259.234 g·mol−1
Heat of Formation -823.1 ± 16.7 kJ·mol−1
Dipole Moment 4.86 ± 1.08 D
Volume 282.63 Å 3
Surface Area 251.18 Å 2
HOMO Energy -9.72 ± 0.55 eV
LUMO Energy 2.41 ± eV
Point Group Symmetry C1
Synonyms
  • 4-amino-1-[(2r,3s,4s,5r)-3-(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-2-pyrimidinone
  • 4-amino-1-[(2r,3s,4s,5r)-3-(fluoromethyl)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2r,3s,4s,5r)-3-(fluoromethyl)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]pyrimidin-2-one
InChIKey GWIVLMCBGFOGLA-JWIUVKOKSA-N
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