Dieckol
C36H22O18
88095-77-6 Copyright (C) 2025 ACS
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M  END
> <cas.rn>
88095-77-6

> <ca.index.name>
Dibenzo[b,e][1,4]dioxin-1,3,6,8-tetrol, 4-[4-[[6-(3,5-dihydroxyphenoxy)-4,7,9-trihydroxydibenzo[b,e][1,4]dioxin-2-yl]oxy]-3,5-dihydroxyphenoxy]-

> <molecular.formula>
C36H22O18

> <smiles.canonical>
OC=1C=C(O)C=C(OC2=C(O)C=C(O)C=3OC4=CC(OC5=C(O)C=C(OC6=C(O)C=C(O)C=7OC=8C=C(O)C=C(O)C8OC67)C=C5O)=CC(O)=C4OC23)C1

> <molecular.weight>
742.55

> <melting.point.experimental>
278 °C

> <boiling.point.predicted>
999.607±65.00 °C    Press: 760.00 Torr

> <density.predicted>
1.850±0.06 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
7.634±0.20    Most Acidic Temp: 25 °C

$$$$
