5,7-Dihydroxy-3-(2-Hydroxy-4,5-Dimethoxyphenyl)-4H-Chromen-4-One

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Properties Simple | Detailed

Formula C17H14O7
IUPAC Name 5,7-dihydroxy-3-(2-hydroxy-4,5-dimethoxy-phenyl)chromen-4-one
Molecular Mass 330.289 g·mol−1
Heat of Formation -952.5 ± 16.7 kJ·mol−1
Dipole Moment 1.15 ± 1.08 D
Volume 356.47 Å 3
Surface Area 319.97 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry C1
Synonyms
  • 2'-hmba
  • 2'-hydroxy-5'-methoxybiochanin a
  • 5,7-dihydroxy-3-(2-hydroxy-4,5-dimethoxy-phenyl)chromone
  • 5,7-dihydroxy-3-(2-hydroxy-4,5-dimethoxyphenyl)-4-chromenone
  • 5,7-dihydroxy-3-(2-hydroxy-4,5-dimethoxyphenyl)chromen-4-one
CAS Number(s)
  • 122127-74-6
InChIKey XTQFIPOLABHASM-UHFFFAOYSA-N
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