1-(2-Deoxy-2-Fluoro-β-D-Arabinofuranosyl)-5-Ethyl-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C11H15FN2O5++
IUPAC Name 5-ethyl-1-[(2r,3s,4r,5r)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
Molecular Mass 274.246 g·mol−1
Heat of Formation -1093.0 ± 16.7 kJ·mol−1
Dipole Moment 5.48 ± 1.08 D
Volume 303.74 Å 3
Surface Area 263.11 Å 2
HOMO Energy -9.53 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(2-deoxy-2-fluoro-beta-d-arabinofuranosyl)-5-ethyluracil
  • 1-(2-deoxy-2-fluoroarabinofuranosyl)-5-ethyluracil
  • 1-dfafeu
  • 2'-fluoro-5-ethyl-.beta.-d-arabinofuranosyluracil
  • 2,4(1h,3h)-pyrimidinedione, 1-(2-deoxy-2-fluoro-beta-d-arabinofuranosyl)-5-ethyl
  • 5-ethyl-1-[(2r,3s,4r,5r)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]pyrimidine-2,4-dione
  • 5-ethyl-1-[(2r,3s,4r,5r)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
  • 5-ethyl-1-[(2r,3s,4r,5r)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
  • 5-ethyl-1-[(2r,3s,4r,5r)-3-fluoro-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]pyrimidine-2,4-quinone
  • feau
CAS Number(s)
  • 83546-42-3
InChIKey SWFJAJRDLUUIOA-IBCQBUCCSA-N
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