1-(7-Hydroxy-2,2-Dimethyl-2H-Chromen-6-Yl)-3-(4-Hydroxyphenyl)-1,3-Propanedione

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Properties Simple | Detailed

Formula C20H18O5
IUPAC Name 1-(7-hydroxy-2,2-dimethyl-chromen-6-yl)-3-(4-hydroxyphenyl)propane-1,3-dione
Molecular Mass 338.354 g·mol−1
Heat of Formation -661.0 ± 16.7 kJ·mol−1
Dipole Moment 7.29 ± 1.08 D
Volume 395.26 Å 3
Surface Area 351.8 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy -0.55 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(7-hydroxy-2,2-dimethyl-2h-1-benzopyran-6-yl)-3-(4-hydroxy-phenyl)-propane-1,3-dione
  • 1-(7-hydroxy-2,2-dimethyl-6-chromenyl)-3-(4-hydroxyphenyl)propane-1,3-dione
  • 1-(7-hydroxy-2,2-dimethylchromen-6-yl)-3-(4-hydroxyphenyl)propane-1,3-dione
  • glyinflanin b
CAS Number(s)
  • 142750-23-0
InChIKey KXBWVUQZNQMUBZ-UHFFFAOYSA-N
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