5,3'-Dihydroxy-4',5'-Dimethoxy-6,7-Methylenedioxyisoflavone

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Properties Simple | Detailed

Formula C18H14O8
IUPAC Name 9-hydroxy-7-(3-hydroxy-4,5-dimethoxy-phenyl)-[1,3]dioxolo[4,5-g]chromen-8-one
Molecular Mass 358.299 g·mol−1
Heat of Formation -978.5 ± 16.7 kJ·mol−1
Dipole Moment 2.75 ± 1.08 D
Volume 370.7 Å 3
Surface Area 335.49 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy -0.95 ± eV
Point Group Symmetry C1
Synonyms
  • 8h-1,3-dioxolo(4,5-g)(1)benzopyran-8-one, 9-hydroxy-7-(3-hydroxy-4,5-dimethoxyphenyl)-
  • 9-hydroxy-7-(3-hydroxy-4,5-dimethoxy-phenyl)pyrano[2,3-f][1,3]benzodioxol-8-one
  • 9-hydroxy-7-(3-hydroxy-4,5-dimethoxyphenyl)-8-pyrano[2,3-f][1,3]benzodioxolone
  • 9-hydroxy-7-(3-hydroxy-4,5-dimethoxyphenyl)pyrano[2,3-f][1,3]benzodioxol-8-one
  • dichotomitin
CAS Number(s)
  • 88509-91-5
InChIKey PFFOGGCBLWTCPM-UHFFFAOYSA-N
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