6-[5-(5,7-Dihydroxy-4-Oxo-4H-Chromen-2-Yl)-2-Hydroxyphenyl]-5,7-Dihydroxy-2-(4-Hydroxyphenyl)-4H-Chromen-4-One

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Properties Simple | Detailed

Formula C30H18O10
IUPAC Name 6-[5-(5,7-dihydroxy-4-oxo-chromen-2-yl)-2-hydroxy-phenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
Molecular Mass 538.458 g·mol−1
Heat of Formation -1294.1 ± 16.7 kJ·mol−1
Dipole Moment 5.73 ± 1.08 D
Volume 566.39 Å 3
Surface Area 492.77 Å 2
HOMO Energy -9.37 ± 0.55 eV
LUMO Energy 1.90 ± eV
Point Group Symmetry C1
Synonyms
  • 3',6''-biapigenin
  • 4h-1-benzopyran-4-one, 6-(5-(5,7-dihydroxy-4-oxo-4h-1-benzopyran-2-yl)-2-hydroxyphenyl)-5,7-dihydroxy-2-(4-hydroxyphenyl)
  • 4h-1-benzopyran-4-one, 6-[5-(5,7-dihydroxy-4-oxo-4h-1-benzopyran-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl-
  • 6-[5-(5,7-dihydroxy-4-keto-chromen-2-yl)-2-hydroxy-phenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromone
  • 6-[5-(5,7-dihydroxy-4-oxo-2-chromenyl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4-chromenone
  • 6-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
CAS Number(s)
  • 49620-13-5
InChIKey BORWSEZUWHQTOK-UHFFFAOYSA-N
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