1-(2-Deoxy-β-D-Erythro-Pentofuranosyl)-2-Ethoxy-5-Methyl-4(1H)-Pyrimidinone

Molecule SVG Image

Properties Simple | Detailed

Formula C12H19N2O5+
IUPAC Name 2-ethoxy-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidin-1-ium-3-id-4-one
Molecular Mass 271.290 g·mol−1
Heat of Formation -823.7 ± 16.7 kJ·mol−1
Dipole Moment 6.25 ± 1.08 D
Volume 315.17 Å 3
Surface Area 280.86 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy 0.02 ± eV
Point Group Symmetry C1
Synonyms
  • 2-ethoxy-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-5-methyl-4-pyrimidinone
  • 2-ethoxy-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-pyrimidin-4-one
  • 2-ethoxy-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-4-one
  • 2-ethoxy-1-[(2r,4s,5r)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidin-4-one
  • 2-ethoxy-1-[(2r,4s,5r)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-5-methyl-pyrimidin-4-one
InChIKey ALVZYWVHJVQICM-IVZWLZJFSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N