Flucytosine

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Properties Simple | Detailed

Formula C4H4FN3O
IUPAC Name 6-amino-5-fluoro-1h-pyrimidin-3-ium-2-one
Molecular Mass 129.092 g·mol−1
Heat of Formation -227.4 ± 16.7 kJ·mol−1
Dipole Moment 6.95 ± 1.08 D
Volume 133.26 Å 3
Surface Area 142.25 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy 2.22 ± eV
Point Group Symmetry Cs
Synonyms
  • 2(1h)-pyrimidinone, 4-amino-5-fluoro-
  • 2(1h)-pyrimidinone, 4-amino-5-fluoro- (8ci)(9ci)
  • 2-hydroxy-4-amino-5-fluoropyrimidine
  • 4-amino-5-fluoro-2(1h)-pyrimidinone
  • 4-amino-5-fluoro-2-hyroxypyrimidine
  • 4-amino-5-fluoro-3h-pyrimidin-2-one
  • 4-amino-5-fluoropyrimidin-2(1h)-one
  • 5-fc
  • 5-fluorocystosine
  • 5-fluorocytosin
  • 5-fluorocytosine
  • 5-fluorocytosine-6-3h
  • 6-amino-2-oxo-5-fluoropyrimidine
  • alcobon
  • ancobon
  • ancotil
  • ancotyl
  • bpbio1_000956
  • cytosine, 5-fluoro-
  • cytosine, 5-fluoro- (6ci,7ci,8ci)
  • d00323
  • drg-0049
  • flucitosina [dcit]
  • flucytosin
  • flucytosine (jp15/usp/inn)
  • flucytosone
  • fluocytosine
  • fluorcytosine
  • fluorocytosine
  • gl663142 & 5fc
  • ro 2-9915
  • ro 29915 e/265601
CAS Number(s)
  • 2022-85-7
InChIKey XRECTZIEBJDKEO-UHFFFAOYSA-N
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