2-Amino-3-Hydroxy-3,7-Dihydro-6H-Purin-6-One

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Properties Simple | Detailed

Formula C5H5N5O2
IUPAC Name 2-amino-3-hydroxy-7h-purin-6-one
Molecular Mass 167.125 g·mol−1
Heat of Formation 67.3 ± 16.7 kJ·mol−1
Dipole Moment 3.55 ± 1.08 D
Volume 170.27 Å 3
Surface Area 171.93 Å 2
HOMO Energy -9.51 ± 0.55 eV
LUMO Energy 2.07 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-3-hydroxy-7h-purin-6-one
  • 2-amino-6h-purin-6-one 3-oxide
  • 2-amino-7h-35-purine-3,6-diol
  • 6h-purin-6-one, 2-amino-, 3-oxide
  • 6h-purin-6-one, 2-amino-, 3-oxide (9ci)
  • 6h-purin-6-one, 2-amino-3,7-dihydro-3-hydroxy-
  • guanine 3-n-oxide
  • guanine, 3-oxide
  • guanine, 3-oxide (8ci)
  • guanine-3-n-oxide
CAS Number(s)
  • 18905-29-8
  • 30345-22-3
InChIKey GUFNQGMGUWTPCE-UHFFFAOYSA-N
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