5-Hydroxy-2'-Methoxy-6,7-Methylenedioxyisoflavone

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Properties Simple | Detailed

Formula C17H12O6
IUPAC Name 9-hydroxy-7-(2-methoxyphenyl)-[1,3]dioxolo[4,5-g]chromen-8-one
Molecular Mass 312.274 g·mol−1
Heat of Formation -646.0 ± 16.7 kJ·mol−1
Dipole Moment 1.85 ± 1.08 D
Volume 334.42 Å 3
Surface Area 297.36 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy -0.89 ± eV
Point Group Symmetry C1
Synonyms
  • 8h-1,3-dioxolo(4,5-g)(1)benzopyran-8-one, 9-hydroxy-7-(2-methoxyphenyl)-
  • 9-hydroxy-7-(2-methoxyphenyl)-8-pyrano[2,3-f][1,3]benzodioxolone
  • 9-hydroxy-7-(2-methoxyphenyl)pyrano[2,3-f][1,3]benzodioxol-8-one
  • irisone a
CAS Number(s)
  • 2652-16-6
InChIKey DWGZUNVIWVMPBQ-UHFFFAOYSA-N
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