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

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Formula C9H11FN2O5++
IUPAC Name 1-[(2r,3s,4r,5r)-3,4-dihydroxy-5-methyl-tetrahydrofuran-2-yl]-5-fluoro-pyrimidine-2,4-dione
Molecular Mass 246.192 g·mol−1
Heat of Formation -1042.6 ± 16.7 kJ·mol−1
Dipole Moment 3.73 ± 1.08 D
Volume 251.82 Å 3
Surface Area 224.87 Å 2
HOMO Energy -9.79 ± 0.55 eV
LUMO Energy 2.24 ± eV
Point Group Symmetry C1
Synonyms
  • 1-[(2r,3s,4r,5r)-3,4-dihydroxy-5-methyl-2-tetrahydrofuranyl]-5-fluoropyrimidine-2,4-dione
  • 1-[(2r,3s,4r,5r)-3,4-dihydroxy-5-methyl-oxolan-2-yl]-5-fluoro-pyrimidine-2,4-dione
  • 1-[(2r,3s,4r,5r)-3,4-dihydroxy-5-methyl-tetrahydrofuran-2-yl]-5-fluoro-pyrimidine-2,4-dione
  • 1-[(2r,3s,4r,5r)-3,4-dihydroxy-5-methyl-tetrahydrofuran-2-yl]-5-fluoro-pyrimidine-2,4-quinone
InChIKey ZWAOHEXOSAUJHY-GPJNPLOBSA-N
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