4-Aminopyrazolo(3,4-D)Pyrimidine

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Properties Simple | Detailed

Formula C5H5N5
IUPAC Name pyrazolo[3,4-d]pyrimidin-1-ium-2-id-4-amine
Molecular Mass 135.127 g·mol−1
Heat of Formation 315.9 ± 16.7 kJ·mol−1
Dipole Moment 3.04 ± 1.08 D
Volume 147.99 Å 3
Surface Area 153.88 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy 2.37 ± eV
Point Group Symmetry Cs
Synonyms
  • 1h-pyrazolo(3,4-d)pyrimidin-4-amine
  • 1h-pyrazolo(3,4-d)pyrimidine, 4-amino-
  • 1h-pyrazolo[3,4-d]pyrimidin-4-amine
  • 1h-pyrazolo[3,4-d]pyrimidin-4-ylamine
  • 1h-pyrazolo[3,4-d]pyrimidine, 4-amino-
  • 1h-pyrazolo[4,3-e]pyrimidin-4-amine
  • 1h-pyrazolo[4,3-e]pyrimidin-4-ylamine
  • 4 app
  • 4-amino-pyrazolo[3,4-d]pyrimidine
  • 4-aminopyrazole(3,4-d)pyrimidine
  • 4-aminopyrazole[3,4-d]pyrimidine
  • 4-aminopyrazolo[3,4-d]pyrimidine
  • 4-aminopyrazolopyrimidine
  • 4-app
  • 4h-pyrazolo[3,4-d]pyrimidin-4-amine
  • 8-aza-7-deazaadenine
  • ab-323/25048512
  • adenine antimetabolite
  • pyrazolo[3,4-d]pyrimidin-4-amin
  • pyrazoloadenine
CAS Number(s)
  • 2380-63-4
InChIKey LHCPRYRLDOSKHK-UHFFFAOYSA-N
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Elements H C N