4',5-Dihydroxy-6,7,8-Trimethoxyflavone

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Properties Simple | Detailed

Formula C18H16O7
IUPAC Name 5-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxy-chromen-4-one
Molecular Mass 344.315 g·mol−1
Heat of Formation -867.2 ± 16.7 kJ·mol−1
Dipole Moment 4.12 ± 1.08 D
Volume 381.17 Å 3
Surface Area 337.61 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -1.06 ± eV
Point Group Symmetry C1
Synonyms
  • 4h-1-benzopyran-4-one, 5-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxy-
  • 5-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxy-4-chromenone
  • 5-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxy-4h-1-benzopyran-4-one
  • 5-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxy-chromone
  • 5-hydroxy-2-(4-hydroxyphenyl)-6,7,8-trimethoxychromen-4-one
  • acon1_000922
  • xanthomicrol
CAS Number(s)
  • 16545-23-6
InChIKey SAMBWAJRKKEEOR-UHFFFAOYSA-N
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