3-Hydroxy-2-(4-Hydroxyphenyl)-6,7-Dimethoxy-4H-Chromen-4-One

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Properties Simple | Detailed

Formula C17H15O6+
IUPAC Name 3-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-chromen-4-one
Molecular Mass 315.297 g·mol−1
Heat of Formation -696.5 ± 16.7 kJ·mol−1
Dipole Moment 2.19 ± 1.08 D
Volume 345.06 Å 3
Surface Area 316.92 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -0.77 ± eV
Point Group Symmetry C1
Synonyms
  • 3-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-4-chromenone
  • 3-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-4h-1-benzopyran-4-one
  • 3-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-chromone
  • 3-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxychromen-4-one
  • 4h-1-benzopyran-4-one, 3-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-
  • hortensin
CAS Number(s)
  • 123442-39-7
InChIKey HJNLHRFLGKGWLI-UHFFFAOYSA-N
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