1,9-Dimethylhypoxanthine

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Properties Simple | Detailed

Formula C7H8N4O
IUPAC Name 1,9-dimethylpurin-6-one
Molecular Mass 164.165 g·mol−1
Heat of Formation 69.2 ± 16.7 kJ·mol−1
Dipole Moment 5.38 ± 1.08 D
Volume 188.12 Å 3
Surface Area 187.14 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -0.85 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,9-dimethyl-1,9-dihydro-6h-purin-6-one
  • 1,9-dimethyl-6-purinone
  • 1,9-dimethylpurin-6-one
  • 6h-purin-6-one, 1,9-dihydro-1,9-dimethyl-
InChIKey KIHZGMYZXVZBRG-UHFFFAOYSA-N
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