(6R,7R)-6,7-Dihydroxy-7-Methyl-3-[(1E,3E)-1,3-Pentadien-1-Yl]-1,5,6,7-Tetrahydro-8H-Isochromen-8-One

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Formula C15H18O4
IUPAC Name (6r,7r)-6,7-dihydroxy-7-methyl-3-[(1e,3e)-penta-1,3-dienyl]-5,6-dihydro-1h-isochromen-8-one
Molecular Mass 262.301 g·mol−1
Heat of Formation -562.0 ± 16.7 kJ·mol−1
Dipole Moment 7.14 ± 1.08 D
Volume 312.95 Å 3
Surface Area 293.48 Å 2
HOMO Energy -8.68 ± 0.55 eV
LUMO Energy -1.13 ± eV
Point Group Symmetry C1
Synonyms
  • (6r,7r)-6,7-dihydroxy-7-methyl-3-[(1e,3e)-penta-1,3-dienyl]-5,6-dihydro-1h-isochromen-8-one
  • harziphilone
CAS Number(s)
  • 183239-75-0
InChIKey GFTDIFRKHSPLIX-VNLWOOSYSA-N
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