1,3,5,8-Tetrahydroxy-9H-Xanthen-9-One

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Properties Simple | Detailed

Formula C13H9O6+
IUPAC Name 1,3,5,8-tetrahydroxyxanthen-9-one
Molecular Mass 261.207 g·mol−1
Heat of Formation -836.9 ± 16.7 kJ·mol−1
Dipole Moment 2.94 ± 1.08 D
Volume 263.59 Å 3
Surface Area 246.85 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy 2.07 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,3,5,8-tetrahydroxy-9-xanthenone
  • 1,3,5,8-tetrahydroxyxanthone
  • 1,3,5,8-tetrahyroxyxanthen-9-one
  • 9h-xanthen-9-one, 1,3,5,8-tetrahydroxy- (9ci)
  • bellidin
  • demethylbellidifolin
  • desmethybellidifolin
  • desmethylbellidifolin
  • norbellidifodin
  • xanthen-9-one, 1,3,5,8-tetrahydroxy-
CAS Number(s)
  • 2980-32-7
InChIKey MPXAWSABMVLIBU-UHFFFAOYSA-N
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