6-Amino-2-(Piperidin-1-Yl)-9H-Purine-8-Thiol

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Properties Simple | Detailed

Formula C10H14N6S
IUPAC Name 6-amino-2-(1-piperidyl)-7,9-dihydropurine-1,2,3,4,5,6-hexaide-8-thione
Molecular Mass 250.323 g·mol−1
Heat of Formation 251.9 ± 16.7 kJ·mol−1
Dipole Moment 7.45 ± 1.08 D
Volume 281.77 Å 3
Surface Area 268.34 Å 2
HOMO Energy -8.07 ± 0.55 eV
LUMO Energy -0.60 ± eV
Point Group Symmetry C1
Synonyms
  • 2-piperidino-8-mercaptoadenine
  • 6-amino-2-(1-piperidyl)-7,9-dihydropurine-8-thione
  • 6-amino-2-piperidin-1-yl-7,9-dihydropurine-8-thione
  • 6-amino-2-piperidino-7,9-dihydropurine-8-thione
  • 8h-purine-8-thione, 6-amino-1,7-dihydro-2-(1-piperidinyl)-
CAS Number(s)
  • 25061-78-3
InChIKey YCVIIXWMEWGUNE-UHFFFAOYSA-N
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