1-[(1R,2R,3R)-2-(3,5-Dihydroxy-Phenyl)-4,6-Dihydroxy-3-(4-Hydroxy-Phenyl)-Indan-1-Yl]-1-(4-Hydroxy-Phenyl)-Methanone

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Formula C28H22O7
IUPAC Name [(1r,2r,3r)-2-(3,5-dihydroxyphenyl)-4,6-dihydroxy-3-(4-hydroxyphenyl)indan-1-yl]-(4-hydroxyphenyl)methanone
Molecular Mass 470.470 g·mol−1
Heat of Formation -913.2 ± 16.7 kJ·mol−1
Dipole Moment 4.00 ± 1.08 D
Volume 530.65 Å 3
Surface Area 404.78 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy -0.55 ± eV
Point Group Symmetry C1
Synonyms
  • [(1r,2r,3r)-2-(3,5-dihydroxyphenyl)-4,6-dihydroxy-3-(4-hydroxyphenyl)-1-indanyl]-(4-hydroxyphenyl)methanone
  • [(1r,2r,3r)-2-(3,5-dihydroxyphenyl)-4,6-dihydroxy-3-(4-hydroxyphenyl)-2,3-dihydro-1h-inden-1-yl]-(4-hydroxyphenyl)methanone
  • [(1r,2r,3r)-2-(3,5-dihydroxyphenyl)-4,6-dihydroxy-3-(4-hydroxyphenyl)indan-1-yl]-(4-hydroxyphenyl)methanone
  • caraphenol c
InChIKey NNTKNQXSDDQTKC-WEWMWRJBSA-N
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