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

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Properties Simple | Detailed

Formula C10H15N3O5+
IUPAC Name 4-amino-1-[(2r,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 -754.7 ± 16.7 kJ·mol−1
Dipole Moment 7.05 ± 1.08 D
Volume 287.89 Å 3
Surface Area 260.0 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy -0.14 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(2-o-methyl-beta-d-arabinofuranosyl)cytosine
  • 2(1h)-pyrimidinone, 4-amino-1-(2-o-methyl-b-d-arabinofuranosyl)-
  • 2(1h)-pyrimidinone, 4-amino-1-(2-o-methyl-beta-d-arabinofuranosyl)- (9ci)
  • 4-amino-1-[(2r,3s,4r,5r)-4-hydroxy-3-methoxy-5-methylol-tetrahydrofuran-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2r,3s,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-2-tetrahydrofuranyl]-2-pyrimidinone
  • 4-amino-1-[(2r,3s,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-oxolan-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2r,3s,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxy-tetrahydrofuran-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2r,3s,4r,5r)-4-hydroxy-5-(hydroxymethyl)-3-methoxyoxolan-2-yl]pyrimidin-2-one
InChIKey RFCQJGFZUQFYRF-BUJSFMDZSA-N
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