4-[(1R)-1-Hydroxyethyl]-5-Methyl-1-(β-D-Ribofuranosyl)-1H-Imidazole

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Properties Simple | Detailed

Formula C11H18N2O5
IUPAC Name (2r,3r,4s,5r)-2-[4-[(1r)-1-hydroxyethyl]-5-methyl-imidazol-1-ium-5-ylium-1-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 258.271 g·mol−1
Heat of Formation -864.6 ± 16.7 kJ·mol−1
Dipole Moment 5.19 ± 1.08 D
Volume 300.66 Å 3
Surface Area 268.5 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy 0.41 ± eV
Point Group Symmetry C1
Synonyms
  • (1-hydroxyethyl)-5-methyl-1-beta-ribofuranosylimidazole
  • (2r,3r,4s,5r)-2-[4-(1-hydroxyethyl)-5-methyl-1-imidazolyl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[4-(1-hydroxyethyl)-5-methyl-imidazol-1-yl]-5-(hydroxymethyl)oxolane-3,4-diol
  • (2r,3r,4s,5r)-2-[4-(1-hydroxyethyl)-5-methyl-imidazol-1-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[4-(1-hydroxyethyl)-5-methyl-imidazol-1-yl]-5-methylol-tetrahydrofuran-3,4-diol
  • (2r,3r,4s,5r)-2-[4-(1-hydroxyethyl)-5-methylimidazol-1-yl]-5-(hydroxymethyl)oxolane-3,4-diol
  • 1-hemri
CAS Number(s)
  • 98483-26-2
InChIKey VMPSPVJCVIVEIK-JBSYKWBFSA-N
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