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

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Properties Simple | Detailed

Formula C9H10F2N2O5++
IUPAC Name 5-fluoro-1-[(2s,3r,4s,5s)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
Molecular Mass 264.183 g·mol−1
Heat of Formation -1204.2 ± 16.7 kJ·mol−1
Dipole Moment 4.14 ± 1.08 D
Volume 265.55 Å 3
Surface Area 238.22 Å 2
HOMO Energy -9.97 ± 0.55 eV
LUMO Energy 2.09 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(2'-deoxy-2'-fluoro-beta-arabinofuranosyl)-5-fluorouracil
  • 1-(2-deoxy-2-fluoro-beta-l-arabinofuranosyl)-5-fluoro-uracil
  • 2',5-difluoro-1-arabinosyluracil
  • 2',5-difluoro-2'-deoxy-1-arabinosyluracil
  • 2'-f-ara-fu
  • 2,4(1h,3h)-pyrimidinedione, 1-(2-deoxy-2-fluoro-beta-d-arabinofuranosyl)-5-fluoro-
  • 5-fluoro-1-[(2s,3r,4s,5s)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]pyrimidine-2,4-dione
  • 5-fluoro-1-[(2s,3r,4s,5s)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
  • 5-fluoro-1-[(2s,3r,4s,5s)-3-fluoro-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]pyrimidine-2,4-quinone
  • ff-ara-ura
CAS Number(s)
  • 69123-95-1
InChIKey QURNODSOJKSTBM-GCJQMDKQSA-N
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