5-Hydroxy-2-(3-Hydroxy-4-Methoxyphenyl)-6,7-Dimethoxy-4H-Chromen-4-One

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Properties Simple | Detailed

Formula C18H16O7
IUPAC Name 5-hydroxy-2-(3-hydroxy-4-methoxy-phenyl)-6,7-dimethoxy-chromen-4-one
Molecular Mass 344.315 g·mol−1
Heat of Formation -908.6 ± 16.7 kJ·mol−1
Dipole Moment 5.40 ± 1.08 D
Volume 373.85 Å 3
Surface Area 340.37 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 2.04 ± eV
Point Group Symmetry C1
Synonyms
  • 3',5-dihydroxy-4',6,7-trimethoxyflavone
  • 4h-1-benzopyran-4-one, 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,7-dimethoxy-
  • 4h-1-benzopyran-4-one, 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,7-dimethoxy- (9ci)
  • 5-hydroxy-2-(3-hydroxy-4-methoxy-phenyl)-6,7-dimethoxy-chromone
  • 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,7-dimethoxy-4-chromenone
  • 5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,7-dimethoxychromen-4-one
  • acon1_001351
  • eupatorin
  • eupatorine
  • flavone, 3',5-dihydroxy-4',6,7-trimethoxy-
  • flavone, 3',5-dihydroxy-4',6,7-trimethoxy- (8ci)
CAS Number(s)
  • 855-96-9
InChIKey KLAOKWJLUQKWIF-UHFFFAOYSA-N
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