Prunetin

Molecule SVG Image

Properties Simple | Detailed

Formula C16H12O5
IUPAC Name 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-chromen-4-one
Molecular Mass 284.263 g·mol−1
Heat of Formation -621.3 ± 16.7 kJ·mol−1
Dipole Moment 2.43 ± 1.08 D
Volume 309.43 Å 3
Surface Area 287.0 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.75 ± eV
Point Group Symmetry C1
Synonyms
  • 4',5-dihydroxy-7-methoxyisoflavone
  • 4h-1-benzopyran-4-one, 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-
  • 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4-benzopyrone
  • 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4-chromenone
  • 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4h-1-benzopyran-4-one
  • 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-4h-chromen-4-one
  • 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxy-chromone
  • 5-hydroxy-3-(4-hydroxyphenyl)-7-methoxychromen-4-one
  • isoflavone, 4',5-dihydroxy-7-methoxy- (7ci,8ci)
  • oprea1_083784
  • prunetin (6ci)
  • smp1_000150
CAS Number(s)
  • 552-59-0
InChIKey KQMVAGISDHMXJJ-UHFFFAOYSA-N
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