5,5'-Dihydroxy-8,8'-Dimethoxy-2,2'-Dimethyl-4H,4'H-7,7'-Bibenzo[G]Chromene-4,4',6,6',9,9'-Hexone

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Properties Simple | Detailed

Formula C30H20O12++
IUPAC Name 5-hydroxy-7-(5-hydroxy-8-methoxy-2-methyl-4,6,9-trioxo-benzo[g]chromen-7-yl)-8-methoxy-2-methyl-benzo[g]chromene-4,6,9-trione
Molecular Mass 572.473 g·mol−1
Heat of Formation -1446.6 ± 16.7 kJ·mol−1
Dipole Moment 7.28 ± 1.08 D
Volume 576.6 Å 3
Surface Area 497.56 Å 2
HOMO Energy -9.54 ± 0.55 eV
LUMO Energy -1.98 ± eV
Point Group Symmetry C1
Synonyms
  • (7,7'-bi-4h-naphtho(2,3-b)pyran)-4,4',6,6',9,9'-hexone, 5,5'-dihydroxy-8,8'-dimethoxy-2,2'-dimethyl-
  • 5-hydroxy-7-(5-hydroxy-4,6,9-triketo-8-methoxy-2-methyl-benzo[g]chromen-7-yl)-8-methoxy-2-methyl-benzo[g]chromene-4,6,9-trione
  • 5-hydroxy-7-(5-hydroxy-8-methoxy-2-methyl-4,6,9-trioxo-7-benzo[g]chromenyl)-8-methoxy-2-methylbenzo[g]chromene-4,6,9-trione
  • 5-hydroxy-7-(5-hydroxy-8-methoxy-2-methyl-4,6,9-trioxobenzo[g]chromen-7-yl)-8-methoxy-2-methylbenzo[g]chromene-4,6,9-trione
  • airofusorin
  • aurofusarin
CAS Number(s)
  • 13191-64-5
  • 1402-94-4
InChIKey VSWWTKVILIZDGX-UHFFFAOYSA-N
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