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

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Properties Simple | Detailed

Formula C5H4N4O2
IUPAC Name 7-hydroxy-3,8-dihydro-2h-purine-1,2,4,5,8,9-hexaid-6-one
Molecular Mass 152.111 g·mol−1
Heat of Formation 85.9 ± 16.7 kJ·mol−1
Dipole Moment 3.23 ± 1.08 D
Volume 154.47 Å 3
Surface Area 158.46 Å 2
HOMO Energy -9.45 ± 0.55 eV
LUMO Energy 2.23 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,9-dihydro-6h-purin-6-one 7-oxide
  • 6h-purin-6-one, 1,9-dihydro-, 7-oxide
  • 7-hydroxy-3h-purin-6-one
  • hypoxanthine 7-n-oxide
CAS Number(s)
  • 118974-81-5
InChIKey RBAILXDIIWBFAV-UHFFFAOYSA-N
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