(4S,4Ar,7R,7As)-4,7-Dimethylhexahydrocyclopenta[C]Pyran-3(1H)-One

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Formula C10H16O2
IUPAC Name (4s,4ar,7r,7as)-4,7-dimethyl-4,4a,5,6,7,7a-hexahydro-1h-cyclopenta[c]pyran-3-one
Molecular Mass 168.233 g·mol−1
Heat of Formation -457.4 ± 16.7 kJ·mol−1
Dipole Moment 5.06 ± 1.08 D
Volume 217.83 Å 3
Surface Area 200.0 Å 2
HOMO Energy -10.28 ± 0.55 eV
LUMO Energy 1.23 ± eV
Point Group Symmetry C1
Synonyms
  • (4s,4ar,7r,7as)-4,7-dimethyl-4,4a,5,6,7,7a-hexahydro-1h-cyclopenta[d]pyran-3-one
  • cyclopenta(c)pyran-3(1h)-one, hexahydro-4,7-dimethyl-, (4s-(4-alpha,4a-alpha,7-alpha,7a-alpha))-
  • iridolactone
CAS Number(s)
  • 573-94-4
InChIKey LYEFRAMOOLOUKA-XGEHTFHBSA-N
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