(2Ar,3R,4As,6S,7As,7Br)-3-Hydroxy-6-(Hydroxymethyl)-3,6,7B-Trimethyldecahydro-4H-Cyclobuta[E]Inden-4-One

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Formula C15H24O3
IUPAC Name (2ar,3r,4as,6s,7as,7br)-3-hydroxy-6-(hydroxymethyl)-3,6,7b-trimethyl-2,2a,4a,5,7,7a-hexahydro-1h-cyclobuta[e]inden-4-one
Molecular Mass 252.349 g·mol−1
Heat of Formation -631.5 ± 16.7 kJ·mol−1
Dipole Moment 1.78 ± 1.08 D
Volume 325.08 Å 3
Surface Area 270.12 Å 2
HOMO Energy -9.76 ± 0.55 eV
LUMO Energy 0.34 ± eV
Point Group Symmetry C1
Synonyms
  • 3-hydroxy-6-hydroxymethyl-3,6,7b-trimethyl-decahydro-cyclobuta[e]inden-4-one
  • 4h-cyclobut[e]inden-4-one, decahydro-3-hydroxy-6-(hydroxymethyl)-3,6,7b-trimethyl-, (2ar,3r,4as,6s,7as,7br)-
  • illudiolone
  • rel-(2ar,3r,4as,6s,7as,7br)-3-hydroxy-6-(hydroxymethyl)-3,6,7b-trimethyldecahydro-4h-cyclobuta[e]inden-4-one
InChIKey HSASJPCIWZMQPM-PAUVFPHUSA-N
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