4-Amino-1-(2-Deoxy-2-Methyl-β-D-Arabinofuranosyl)-2(1H)-Pyrimidinone

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Properties Simple | Detailed

Formula C10H15N3O4
IUPAC Name 4-amino-1-[(2r,3s,4s,5r)-4-hydroxy-5-(hydroxymethyl)-3-methyl-tetrahydrofuran-2-yl]pyrimidin-2-one
Molecular Mass 241.244 g·mol−1
Heat of Formation -655.3 ± 16.7 kJ·mol−1
Dipole Moment 4.65 ± 1.08 D
Volume 272.8 Å 3
Surface Area 242.31 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy 2.64 ± eV
Point Group Symmetry C1
Synonyms
  • 4-amino-1-[(2r,3s,4s,5r)-4-hydroxy-3-methyl-5-methylol-tetrahydrofuran-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2r,3s,4s,5r)-4-hydroxy-5-(hydroxymethyl)-3-methyl-2-tetrahydrofuranyl]-2-pyrimidinone
  • 4-amino-1-[(2r,3s,4s,5r)-4-hydroxy-5-(hydroxymethyl)-3-methyl-oxolan-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2r,3s,4s,5r)-4-hydroxy-5-(hydroxymethyl)-3-methyl-tetrahydrofuran-2-yl]pyrimidin-2-one
InChIKey DYPDKNUWDNOWPU-JWIUVKOKSA-N
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