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

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Properties Simple | Detailed

Formula C8H18N5O+
IUPAC Name 2-amino-7-isopropyl-3,8-dihydropurine-1,2,4,5,8,9-hexaid-6-one
Molecular Mass 200.261 g·mol−1
Heat of Formation 27.3 ± 16.7 kJ·mol−1
Dipole Moment 3.23 ± 1.08 D
Volume 226.22 Å 3
Surface Area 214.12 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy -0.26 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-1,7-dihydro-7-(1-methylethyl)-6h-purin-6-one
  • 2-amino-7-isopropyl-3h-purin-6-one
  • 2-amino-7-propan-2-yl-3h-purin-6-one
  • 7-isopropylguanine
CAS Number(s)
  • 55146-06-0
InChIKey KXZFTQWMIRVQPE-UHFFFAOYSA-N
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