1-(2-Methyl-2-Propanyl)-3-(2-Naphthyl)-1H-Pyrazolo[3,4-D]Pyrimidin-4-Amine

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Properties Simple | Detailed

Formula C19H19N5
IUPAC Name 1-tert-butyl-3-(2-naphthyl)pyrazolo[3,4-d]pyrimidin-1-ium-4-ylium-4-amine
Molecular Mass 317.388 g·mol−1
Heat of Formation 391.8 ± 16.7 kJ·mol−1
Dipole Moment 2.50 ± 1.08 D
Volume 385.6 Å 3
Surface Area 336.5 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy 2.23 ± eV
Point Group Symmetry C1
Synonyms
  • 1-tert-butyl-3-(2-naphthyl)-4-pyrazolo[4,5-e]pyrimidinamine
  • 1-tert-butyl-3-(2-naphthyl)pyrazolo[4,5-e]pyrimidin-4-amine
  • 1-tert-butyl-3-naphthalen-2-yl-pyrazolo[4,5-e]pyrimidin-4-amine
  • [1-tert-butyl-3-(2-naphthyl)pyrazolo[4,5-e]pyrimidin-4-yl]amine
InChIKey ILKDWZKZLIHMFM-UHFFFAOYSA-N
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Elements H C N