(4R,4Ar,6R)-6-Isopropenyl-4,4A-Dimethyl-1,2,3,4,4A,5,6,7-Octahydronaphthalene

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Formula C15H24
IUPAC Name (4r,4ar,6r)-6-isopropenyl-4,4a-dimethyl-2,3,4,5,6,7-hexahydro-1h-naphthalene
Molecular Mass 204.351 g·mol−1
Heat of Formation -83.5 ± 16.7 kJ·mol−1
Dipole Moment 0.97 ± 1.08 D
Volume 293.8 Å 3
Surface Area 247.95 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy 1.26 ± eV
Point Group Symmetry C1
Synonyms
  • (+)-5-epi-aristolochene
  • (4r,4ar,6r)-4,4a-dimethyl-6-(prop-1-en-2-yl)-1,2,3,4,4a,5,6,7-octahydronaphthalene
  • (4r,4ar,6r)-4,4a-dimethyl-6-prop-1-en-2-yl-2,3,4,5,6,7-hexahydro-1h-naphthalene
  • (4r,4ar,6r)-6-isopropenyl-4,4a-dimethyl-2,3,4,5,6,7-hexahydro-1h-naphthalene
  • 4betah-eremophila-9,11-diene
  • epi-aristolochene
InChIKey YONHOSLUBQJXPR-UMVBOHGHSA-N
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