(4Ar,8S,10S,10As,10Bs)-10-Hydroxy-4A,8,10B-Trimethyl-2,3,4A,8,9,10,10A,10B-Octahydro-1H-Benzo[F]Chromen-1-One

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Formula C16H22O3
IUPAC Name (4ar,8s,10s,10as,10bs)-10-hydroxy-4a,8,10b-trimethyl-2,3,8,9,10,10a-hexahydrobenzo[f]chromen-1-one
Molecular Mass 262.344 g·mol−1
Heat of Formation -540.3 ± 16.7 kJ·mol−1
Dipole Moment 2.55 ± 1.08 D
Volume 319.58 Å 3
Surface Area 262.34 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy 0.08 ± eV
Point Group Symmetry C1
Synonyms
  • (4ar,8s,10s,10as,10bs)-10-hydroxy-4a,8,10b-trimethyl-2,3,8,9,10,10a-hexahydrobenzo[f]chromen-1-one
  • (4ar-(4aalpha,8 alpha,10 beta,10balpha))-2,3,4a,8,9,10,10a,10b-octahydro-10-hydroxy-4a,8,10b-trimethyl-1h-naphtho(2,1-b)pyran-1-one
  • ll-n 313
  • ll-n313 zeta
CAS Number(s)
  • 53342-17-9
InChIKey SXHZNZFKZCCMFJ-PIVDIINCSA-N
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