3,5,6-Trihydroxy-3',4',7-Trimethoxyflavone

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Properties Simple | Detailed

Formula C18H16O8
IUPAC Name 2-(3,4-dimethoxyphenyl)-3,5,6-trihydroxy-7-methoxy-chromen-4-one
Molecular Mass 360.315 g·mol−1
Heat of Formation -1046.6 ± 16.7 kJ·mol−1
Dipole Moment 4.01 ± 1.08 D
Volume 385.65 Å 3
Surface Area 347.67 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy -0.83 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(3,4-dimethoxyphenyl)-3,5,6-trihydroxy-7-methoxy-4-chromenone
  • 2-(3,4-dimethoxyphenyl)-3,5,6-trihydroxy-7-methoxy-chromone
  • 2-(3,4-dimethoxyphenyl)-3,5,6-trihydroxy-7-methoxychromen-4-one
  • 3,5,6-trihydroxy-3',4',7'-trimethoxyflavone
  • 4h-1-benzopyran-4-one, 2-(3,4-dimethoxyphenyl)-3,5,6-trihydroxy-7-methoxy-
  • thtmof
CAS Number(s)
  • 99499-83-9
InChIKey CZPFBNZMODZHIK-UHFFFAOYSA-N
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