N~2~-(4-Butylphenyl)-7H-Purine-2,6-Diamine

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Properties Simple | Detailed

Formula C15H18N6
IUPAC Name n2-(4-butylphenyl)purin-7-ium-2,6-diamine
Molecular Mass 282.344 g·mol−1
Heat of Formation 325.6 ± 16.7 kJ·mol−1
Dipole Moment 6.80 ± 1.08 D
Volume 345.05 Å 3
Surface Area 324.09 Å 2
HOMO Energy -8.24 ± 0.55 eV
LUMO Energy -0.47 ± eV
Point Group Symmetry C1
Synonyms
  • (6-amino-7h-purin-2-yl)-(4-butylphenyl)amine
  • 2-(4-n-butylanilino)adenine
  • 2-(p-n-butylanilino)adenine
  • 6-amino-2-((4-butylphenyl)amino)-9h-purine
  • 9h-purine, 6-amino-2-((4-butylphenyl)amino)-
  • n-(4-butylphenyl)-7h-purine-2,6-diamine
  • n~2~-(4-butylphenyl)-9h-purine-2,6-diamine
CAS Number(s)
  • 99304-81-1
InChIKey JSFFGFGRNFFOGA-UHFFFAOYSA-N
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Elements H C N