2-Amino-7-Ethyl-1,7-Dihydro-6H-Purin-6-One

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Properties Simple | Detailed

Formula C7H9N5O
IUPAC Name 2-amino-7-ethyl-3,8-dihydropurine-1,2,4,5,8,9-hexaid-6-one
Molecular Mass 179.179 g·mol−1
Heat of Formation 59.0 ± 16.7 kJ·mol−1
Dipole Moment 3.04 ± 1.08 D
Volume 203.48 Å 3
Surface Area 197.88 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy -0.60 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-7-ethyl-3h-purin-6-one
  • 6h-purin-6-one, 2-amino-7-ethyl-1,7-dihydro- (9ci)
  • 7-ethylguanine
  • guanine, 7-ethyl-
  • hts 11456
  • sr-01000637364-1
CAS Number(s)
  • 19530-88-2
InChIKey ZHJMQAUXHDDIOL-UHFFFAOYSA-N
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