2-(3,4-Dihydroxyphenyl)-5-Hydroxy-3,6,7-Trimethoxy-4H-Chromen-4-One

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Properties Simple | Detailed

Formula C18H16O8
IUPAC Name 2-(3,4-dihydroxyphenyl)-5-hydroxy-3,6,7-trimethoxy-chromen-4-one
Molecular Mass 360.315 g·mol−1
Heat of Formation -1062.0 ± 16.7 kJ·mol−1
Dipole Moment 3.53 ± 1.08 D
Volume 384.7 Å 3
Surface Area 347.01 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy -0.79 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(3,4-dihydroxyphenyl)-5-hydroxy-3,6,7-trimethoxy-4-chromenone
  • 2-(3,4-dihydroxyphenyl)-5-hydroxy-3,6,7-trimethoxy-chromone
  • 2-(3,4-dihydroxyphenyl)-5-hydroxy-3,6,7-trimethoxychromen-4-one
  • 3',4',5-trihydroxy-3,6,7-trimethoxyflavone
  • 3,6,7-trimethylquercetagenin
  • megxp0_000419
CAS Number(s)
  • 14965-20-9
InChIKey BYWLLSQTJBXAPV-UHFFFAOYSA-N
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