2'-Deoxy-5-Fluoro-2'-Methylenecytidine

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Properties Simple | Detailed

Formula C10H12FN3O4
IUPAC Name 4-amino-5-fluoro-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)-3-methylene-tetrahydrofuran-2-yl]pyrimidin-2-one
Molecular Mass 257.218 g·mol−1
Heat of Formation -704.2 ± 16.7 kJ·mol−1
Dipole Moment 4.80 ± 1.08 D
Volume 278.72 Å 3
Surface Area 252.81 Å 2
HOMO Energy -9.44 ± 0.55 eV
LUMO Energy 2.36 ± eV
Point Group Symmetry C1
Synonyms
  • 2'-deoxy-2'-methylidene-5-fluorocytidine
  • 2-dmfc
  • 4-amino-5-fluoro-1-[(2r,4s,5r)-4-hydroxy-3-methylene-5-methylol-tetrahydrofuran-2-yl]pyrimidin-2-one
  • 4-amino-5-fluoro-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)-3-methylene-2-tetrahydrofuranyl]-2-pyrimidinone
  • 4-amino-5-fluoro-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)-3-methylene-tetrahydrofuran-2-yl]pyrimidin-2-one
  • 4-amino-5-fluoro-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)-3-methylidene-oxolan-2-yl]pyrimidin-2-one
  • 4-amino-5-fluoro-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)-3-methylideneoxolan-2-yl]pyrimidin-2-one
  • cytidine, 2'-deoxy-5-fluoro-2'-methylene-
CAS Number(s)
  • 129531-96-0
InChIKey CBFZRLQZSOMINR-BKPPORCPSA-N
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