4-Amino-1-(2-O-Methyl-α-D-Arabinofuranosyl)-2(1H)-Pyrimidinone

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Properties Simple | Detailed

Formula C10H15N3O5+
IUPAC Name 4-amino-1-[(2s,3s,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]pyrimidin-2-one
Molecular Mass 257.243 g·mol−1
Heat of Formation -783.7 ± 16.7 kJ·mol−1
Dipole Moment 5.13 ± 1.08 D
Volume 288.19 Å 3
Surface Area 262.53 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry C1
Synonyms
  • 4-amino-1-[(2s,3s,4r,5r)-4-hydroxy-3-methoxy-5-methylol-tetrahydrofuran-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2s,3s,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-2-tetrahydrofuranyl]-2-pyrimidinone
  • 4-amino-1-[(2s,3s,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-oxolan-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2s,3s,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2s,3s,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]pyrimidin-2-one
InChIKey RFCQJGFZUQFYRF-ZLNHGNLKSA-N
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