5,7-Dihydroxy-2-(4-Hydroxyphenyl)-3,6-Dimethoxy-4H-Chromen-4-One

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Properties Simple | Detailed

Formula C17H15O7+
IUPAC Name 5,7-dihydroxy-2-(4-hydroxyphenyl)-3,6-dimethoxy-chromen-4-one
Molecular Mass 331.297 g·mol−1
Heat of Formation -923.7 ± 16.7 kJ·mol−1
Dipole Moment 4.10 ± 1.08 D
Volume 353.14 Å 3
Surface Area 319.52 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy -1.00 ± eV
Point Group Symmetry C1
Synonyms
  • 3,6-dimethoxy-5,7,4'-
  • 4',5,7-trihydroxy-3,6-dimethoxyflavone
  • 5,7-dihydroxy-2-(4-hydroxyphenyl)-3,6-dimethoxy-4-chromenone
  • 5,7-dihydroxy-2-(4-hydroxyphenyl)-3,6-dimethoxy-4h-1-benzopyran-4-one
  • 5,7-dihydroxy-2-(4-hydroxyphenyl)-3,6-dimethoxy-chromone
  • 5,7-dihydroxy-2-(4-hydroxyphenyl)-3,6-dimethoxychromen-4-one
  • trihydroxy-flavone
CAS Number(s)
  • 22697-65-0
InChIKey DDNPCXHBFYJXBJ-UHFFFAOYSA-N
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