4-Amino-5-Fluoro-1-(β-L-Ribofuranosyl)-2(1H)-Pyrimidinone

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Properties Simple | Detailed

Formula C9FN3O5
IUPAC Name carbononitridic isocyanate; (2z)-2-(2-fluoroethynylimino)-5-(oxomethylene)tetrahydrofuran-3,4-dione
Molecular Mass 249.112 g·mol−1
Heat of Formation -99.2 ± 16.7 kJ·mol−1
Dipole Moment 5.86 ± 1.08 D
Volume 225.45 Å 3
Surface Area 208.63 Å 2
HOMO Energy -10.22 ± 0.55 eV
LUMO Energy 0.85 ± eV
Point Group Symmetry C1
Synonyms
  • 4-amino-1-((2s,3s,4r,5s)-3,4-dihydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-fluoro-1-h-pyrimidin-2-one
  • 4-amino-1-[(2s,3s,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-5-fluoro-2-pyrimidinone
  • 4-amino-1-[(2s,3s,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-fluoro-pyrimidin-2-one
  • 4-amino-1-[(2s,3s,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-fluoro-pyrimidin-2-one
  • 4-amino-1-[(2s,3s,4r,5s)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-5-fluoro-pyrimidin-2-one
  • l-.beta.-ribofuranosyl-5-fluoro-cytosine
  • l-5-fluorocytidine
InChIKey STRZQWQNZQMHQR-TYQACLPBSA-N
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