Pseudobaptisin

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Properties Simple | Detailed

Formula C16H10O5
IUPAC Name 3-(1,3-benzodioxol-5-yl)-7-hydroxy-chromen-4-one
Molecular Mass 282.248 g·mol−1
Heat of Formation -480.7 ± 16.7 kJ·mol−1
Dipole Moment 2.19 ± 1.08 D
Volume 303.08 Å 3
Surface Area 280.11 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy 2.26 ± eV
Point Group Symmetry C1
Synonyms
  • .psi.-baptigenin
  • 3-(1,3-benzodioxol-5-yl)-7-hydroxy-4-chromenone
  • 3-(1,3-benzodioxol-5-yl)-7-hydroxy-4h-chromen-4-one
  • 3-(1,3-benzodioxol-5-yl)-7-hydroxy-chromone
  • 4h-1-benzopyran-4-one, 3-(1,3-benzodioxol-5-yl)-7-hydroxy-
  • 7-hydroxy-3', 4'-methylenedioxyisoflavone
  • 7-hydroxy-3',4'-methylenedioxyisoflavone
  • isoflavone, 7-hydroxy-3',4'-(methylenedioxy)-
  • pseudobaptigenin
  • psi-baptigenin
CAS Number(s)
  • 90-29-9
InChIKey KNJNBKINYHZUGC-UHFFFAOYSA-N
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