Isofraxidin

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Properties Simple | Detailed

Formula C11H11O5+
IUPAC Name 7-hydroxy-6,8-dimethoxy-chromen-2-one
Molecular Mass 223.202 g·mol−1
Heat of Formation -625.9 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 243.17 Å 3
Surface Area 230.66 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 1.84 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-1- benzopyran-2-one, 7-hydroxy-6,8-dimethoxy-
  • 2h-1-benzopyran-2-one, 7-hydroxy-6,8-dimethoxy-
  • 7-hydroxy-6,8-dimethoxy-2-chromenone
  • 7-hydroxy-6,8-dimethoxy-2h-1-benzopyran-2-one
  • 7-hydroxy-6,8-dimethoxy-coumarin
  • 7-hydroxy-6,8-dimethoxychromen-2-one
  • coumarin, 7-hydroxy-6,8-dimethoxy-
  • phytodolor
  • umbelliferone, 6,8-dimethoxy-
CAS Number(s)
  • 486-21-5
InChIKey HOEVRHHMDJKUMZ-UHFFFAOYSA-N
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