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

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Properties Simple | Detailed

Formula C17H21N5
IUPAC Name 1-tert-butyl-3-(m-tolylmethyl)pyrazolo[3,4-d]pyrimidin-4-amine
Molecular Mass 295.382 g·mol−1
Heat of Formation 246.3 ± 16.7 kJ·mol−1
Dipole Moment 2.91 ± 1.08 D
Volume 371.32 Å 3
Surface Area 319.07 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy 2.82 ± eV
Point Group Symmetry C1
InChIKey FYCOTGCSHZKHPR-UHFFFAOYSA-N
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Elements H C N