2-Amino-9-[(3S)-3,4-Dihydroxybutyl]-3,9-Dihydro-6H-Purin-6-One

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Properties Simple | Detailed

Formula C9H13N5O3
IUPAC Name 2-amino-9-[(3s)-3,4-dihydroxybutyl]-3,8-dihydropurine-1,2,4,5,7,8-hexaid-6-one
Molecular Mass 239.231 g·mol−1
Heat of Formation -312.7 ± 16.7 kJ·mol−1
Dipole Moment 14.21 ± 1.08 D
Volume 268.31 Å 3
Surface Area 248.85 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 3.08 ± eV
Point Group Symmetry C1
Synonyms
  • 2-amino-9-[(3s)-3,4-dihydroxybutyl]-3h-purin-6-one
InChIKey QOVUZUCXPAZXDZ-YFKPBYRVSA-N
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