(3Ar,4S,6E,10Z,11Ar)-4-Hydroxy-10-(Hydroxymethyl)-6-Methyl-3-Methylene-3A,4,5,8,9,11A-Hexahydrocyclodeca[B]Furan-2(3H)-One

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Formula C15H20O4
IUPAC Name (3ar,4s,6e,10z,11ar)-4-hydroxy-10-(hydroxymethyl)-6-methyl-3-methylene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one
Molecular Mass 264.317 g·mol−1
Heat of Formation -595.5 ± 16.7 kJ·mol−1
Dipole Moment 5.60 ± 1.08 D
Volume 322.56 Å 3
Surface Area 267.47 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy 0.04 ± eV
Point Group Symmetry C1
Synonyms
  • (3ar,4s,6e,10z,11ar)-4-hydroxy-10-(hydroxymethyl)-6-methyl-3-methylene-3a,4,5,8,9,11a-hexahydrocyclodeca[d]furan-2-one
  • (3ar,4s,6e,10z,11ar)-4-hydroxy-10-(hydroxymethyl)-6-methyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[d]furan-2-one
  • (3ar,4s,6e,10z,11ar)-4-hydroxy-6-methyl-3-methylene-10-methylol-3a,4,5,8,9,11a-hexahydrocyclodeca[d]furan-2-one
  • salonitenolide
CAS Number(s)
  • 26931-94-2
InChIKey BLDTUWFMPJJRPR-PNQYDXICSA-N
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