22688-79-5

Name QUERCETIN-3-O-GLUCURONIDE
CAS 22688-79-5
Molecular Formula C21H18O13
MDL Number MFCD04039814
Molecular Weight 478.36
MOL File 22688-79-5.mol

Chemical Properties

Melting point  193~195℃
Boiling point  927.8±65.0 °C(Predicted)
density  1.96±0.1 g/cm3(Predicted)
storage temp.  -20°C
solubility  DMSO (Slightly), Methanol (Slightly)
form  neat
pka 2.76±0.70(Predicted)
color  Yellow to Very Dark Yellow
Stability: Very Hygroscopic
Major Application metabolomics
vitamins, nutraceuticals, and natural products
InChIKey DUBCCGAQYVUYEU-UVXHTARINA-N
SMILES O([C@H]1[C@@H]([C@@H](O)[C@H](O)[C@@H](C(=O)O)O1)O)C1C(C2=C(C=C(O)C=C2OC=1C1C=CC(O)=C(O)C=1)O)=O |&1:1,2,3,5,7,r|
LogP 2.100 (est)

Safety Data

Safety Statements 
WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

Supplier