2',3'-Dideoxy-3'-Fluorocytidine

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Properties Simple | Detailed

Formula C9H12FN3O3
IUPAC Name 4-amino-1-[(2r,4s,5r)-4-fluoro-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one
Molecular Mass 229.208 g·mol−1
Heat of Formation -624.9 ± 16.7 kJ·mol−1
Dipole Moment 8.02 ± 1.08 D
Volume 250.72 Å 3
Surface Area 233.17 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy -0.31 ± eV
Point Group Symmetry C1
Synonyms
  • 3'-fddc
  • 3'-fluoro-2',3'-dideoxycytidine
  • 4-amino-1-[(2r,4s,5r)-4-fluoro-5-(hydroxymethyl)-2-tetrahydrofuranyl]-2-pyrimidinone
  • 4-amino-1-[(2r,4s,5r)-4-fluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2r,4s,5r)-4-fluoro-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2r,4s,5r)-4-fluoro-5-methylol-tetrahydrofuran-2-yl]pyrimidin-2-one
  • cytidine, 2',3'-dideoxy-3'-fluoro-
  • fddc
  • fddcyd
CAS Number(s)
  • 51246-79-8
InChIKey HNSUDSIHCJEYQG-SHYZEUOFSA-N
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