1-Methyl-Guanine

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Properties Simple | Detailed

Formula C6H13N5O
IUPAC Name 2-amino-1-methyl-7,8-dihydropurine-2,3,4,5,8,9-hexaid-6-one
Molecular Mass 171.200 g·mol−1
Heat of Formation 81.7 ± 16.7 kJ·mol−1
Dipole Moment 3.51 ± 1.08 D
Volume 180.27 Å 3
Surface Area 179.51 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
Synonyms
  • 1-methylguanine
  • 2-amino-1,7-dihydro-1-methyl-6h-purin-6-one
  • 2-amino-1-methyl-7h-purin-6-one
  • 2-amino-6-hydroxy-1-methylpurine
  • 6h-purin-6-one, 2-amino-1,7-dihydro-1-methyl-
  • 6h-purin-6-one, 2-amino-1,7-dihydro-1-methyl- (9ci)
  • guanine, 1-methyl-
  • guanine, 1-methyl- (8ci)
  • n1-methylguanine
CAS Number(s)
  • 938-85-2
InChIKey RFLVMTUMFYRZCB-UHFFFAOYSA-N
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