2-Amino-7-(2-Hydroxyethyl)-1,7-Dihydro-6H-Purin-6-One

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Properties Simple | Detailed

Formula C7H9N5O2
IUPAC Name 2-amino-7-(2-hydroxyethyl)-3,8-dihydropurine-1,2,4,5,8,9-hexaid-6-one
Molecular Mass 195.179 g·mol−1
Heat of Formation -104.0 ± 16.7 kJ·mol−1
Dipole Moment 2.26 ± 1.08 D
Volume 211.88 Å 3
Surface Area 206.93 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -0.56 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-1,7-dihydro-7-(2-hydroxyethyl)-6h-purin-6-one
  • 2-amino-7-(2-hydroxyethyl)-3h-purin-6-one
  • 2-amino-7-(2-hydroxyethyl)-7h-purin-6-ol
  • 6h-purin-6-one, 2-amino-1,7-dihydro-7-(2-hydroxyethyl)-
  • 7-(2-hydroxyethyl)guanine
  • n(7)-hydroxyethylguanine
CAS Number(s)
  • 53498-52-5
InChIKey OCAWYYAMQRJCOY-UHFFFAOYSA-N
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