(3Ar,4As,6As,9As,9Bs)-1,4A-Dimethyl-7-Methylene-5,6,6A,7,9A,9B-Hexahydro-3H-Oxireno[8,8A]Azuleno[4,5-B]Furan-8(4Ah)-One

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Properties Simple | Detailed

Formula C15H18O3
IUPAC Name (3ar,4as,6as,9as,9bs)-1,4a-dimethyl-7-methylene-5,6,6a,7,9a,9b-hexahydro-3h-oxireno[8,8a]azuleno[4,5-b]furan-8(4ah)-one
Molecular Mass 246.302 g·mol−1
Heat of Formation -343.0 ± 16.7 kJ·mol−1
Dipole Moment 4.55 ± 1.08 D
Volume 300.6 Å 3
Surface Area 253.38 Å 2
HOMO Energy -9.43 ± 0.55 eV
LUMO Energy 2.70 ± eV
Point Group Symmetry C1
Synonyms
  • (3ar,4as,6as,9as)-1,4a-dimethyl-7-methylene-5,6,6a,7,9a,9b-hexahydro-3h-oxireno[8,8a]azuleno[4,5-b]furan-8(4ah)-one
  • 3h-oxireno[8,8a]azuleno[4,5-b]furan-8(4ah)-one, 5,6,6a,7,9a,9b-hexahydro-1,4a-dimethyl-7-methylene-, (3ar,4as,6as,9as)-
  • arglabin
  • rel-(3ar,4as,6as,9as)-1,4a-dimethyl-7-methylene-5,6,6a,7,9a,9b-hexahydro-3h-oxireno[8,8a]azuleno[4,5-b]furan-8(4ah)-one
CAS Number(s)
  • 84692-91-1
InChIKey UVJYAKBJSGRTHA-ZCRGAIPPSA-N
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