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4839-60-5

Name Chrysophanein
CAS 4839-60-5
Molecular Formula C21H20O9
MDL Number MFCD28964227
Molecular Weight 416.38
MOL File 4839-60-5.mol
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Chemical Properties

Melting point  245-246℃
Boiling point  765.8±60.0 °C(Predicted)
density  1.596±0.06 g/cm3 (20 ºC 760 Torr)
form  Solid
pka 6.71±0.20(Predicted)
color  Light yellow to orange
InChIKey QKPDYSSHOSPOKH-FMQABLMVNA-N
SMILES O([C@H]1[C@@H]([C@@H](O)[C@H](O)[C@@H](CO)O1)O)C1=CC(C)=CC2C(C3=CC=CC(O)=C3C(=O)C1=2)=O |&1:1,2,3,5,7,r|

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