9-Butyl-8-(2,5-Dimethoxybenzyl)-9H-Purin-6-Amine

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Properties Simple | Detailed

Formula C18H23N5O2
IUPAC Name 9-butyl-8-[(2,5-dimethoxyphenyl)methyl]purin-9-ium-6-amine
Molecular Mass 341.408 g·mol−1
Heat of Formation -64.8 ± 16.7 kJ·mol−1
Dipole Moment 3.41 ± 1.08 D
Volume 419.09 Å 3
Surface Area 345.02 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy 2.75 ± eV
Point Group Symmetry C1
Synonyms
  • 9-butyl-8-(2,5-dimethoxy-benzyl)-9h-purin-6-ylamine
  • 9-butyl-8-[(2,5-dimethoxyphenyl)methyl]-6-purinamine
  • [9-butyl-8-(2,5-dimethoxybenzyl)purin-6-yl]amine
  • pu7
InChIKey PPFZLLAIQRZNJE-UHFFFAOYSA-N
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