1,3-Diallyl-8-Cyclohexylxanthine

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Properties Simple | Detailed

Formula C17H22N4O2
IUPAC Name 1,3-diallyl-8-cyclohexyl-7h-purine-2,6-dione
Molecular Mass 314.382 g·mol−1
Heat of Formation -149.3 ± 16.7 kJ·mol−1
Dipole Moment 4.38 ± 1.08 D
Volume 390.83 Å 3
Surface Area 343.44 Å 2
HOMO Energy -8.98 ± 0.55 eV
LUMO Energy 2.59 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-diallyl-8-cyclohexyl-7h-purine-2,6-dione
  • 1,3-diallyl-8-cyclohexyl-7h-purine-2,6-quinone
  • 8-cyclohexyl-1,3-di(prop-2-enyl)-7h-purine-2,6-dione
InChIKey JPIQZRAYPNKFEI-UHFFFAOYSA-N
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