Isoalantolactone

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Properties Simple | Detailed

Formula C15H20O2
IUPAC Name (3ar,4as,8ar,9ar)-8a-methyl-3,5-dimethylene-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one
Molecular Mass 232.318 g·mol−1
Heat of Formation -317.6 ± 16.7 kJ·mol−1
Dipole Moment 4.71 ± 1.08 D
Volume 297.31 Å 3
Surface Area 252.16 Å 2
HOMO Energy -9.82 ± 0.55 eV
LUMO Energy 2.81 ± eV
Point Group Symmetry C1
Synonyms
  • (3ar,4as,8ar,9ar)-8a-methyl-3,5-dimethylene-3a,4,4a,6,7,8,9,9a-octahydrobenzo[f]benzofuran-2-one
  • (3ar,4as,8ar,9ar)-8a-methyl-3,5-dimethylene-decahydro-naphtho[2,3-b]furan-2-one
  • (3ar,4as,8ar,9ar)-8a-methyl-3,5-dimethylidene-3a,4,4a,6,7,8,9,9a-octahydronaphtho[3,2-d]furan-2-one
  • naphtho(2,3-b)furan-2(3h)-one, decahydro-8a-methyl-3,5-bis(methylene)-, (3ar-(3a alpha,4a alpha,8a beta,9a alpha))-
CAS Number(s)
  • 470-17-7
InChIKey CVUANYCQTOGILD-QVHKTLOISA-N
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