4-Amino-2H-Pyrazolo[3,4-D]Pyrimidin-6-Ol

Molecule SVG Image

Properties Simple | Detailed

Formula C5H12N5O+
IUPAC Name 4-amino-2,3-dihydro-1h-pyrazolo[3,4-d]pyrimidine-3,3a,4,5,7,7a-hexaid-6-one
Molecular Mass 158.182 g·mol−1
Heat of Formation 226.3 ± 16.7 kJ·mol−1
Dipole Moment 11.17 ± 1.08 D
Volume 158.2 Å 3
Surface Area 164.02 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy -1.59 ± eV
Point Group Symmetry C1
Synonyms
  • 4-amino-1,2-dihydropyrazolo[3,4-d]pyrimidin-6-one
  • 4-amino-6-hydroxypyrazolo[3,4-d]pyrimidine
  • 4-aminopyrazolo(3,4-d)pyrimidin-6-ol
  • 6h-pyrazolo[3,4-d]pyrimidin-6-one, 4-amino-1,5-dihydro-
  • oprea1_561915
CAS Number(s)
  • 5472-41-3
InChIKey KTQYLKORCCNJTQ-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N