Diphyllin Methyl Ether

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Properties Simple | Detailed

Formula C22H18O7
IUPAC Name 9-(1,3-benzodioxol-5-yl)-4,6,7-trimethoxy-3h-benzo[f]isobenzofuran-1-one
Molecular Mass 394.374 g·mol−1
Heat of Formation -751.6 ± 16.7 kJ·mol−1
Dipole Moment 5.54 ± 1.08 D
Volume 436.7 Å 3
Surface Area 374.89 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy -1.16 ± eV
Point Group Symmetry C1
Synonyms
  • 9-(1,3-benzodioxol-5-yl)-4,6,7-trimethoxy-3h-benzo[f][2]benzoxol-1-one
  • 9-(1,3-benzodioxol-5-yl)-4,6,7-trimethoxy-3h-benzo[f]isobenzofuran-1-one
  • justicidin a
  • justicidins
CAS Number(s)
  • 25001-57-4
InChIKey ANFSXHKDCKWWDB-UHFFFAOYSA-N
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