Ononin Structure

Ononin

Chemical Properties

Melting point 216°C
Boiling point 697.8±55.0 °C(Predicted)
Density  1.482±0.06 g/cm3(Predicted)
storage temp.  Hygroscopic, -20°C Freezer, Under inert atmosphere
solubility  DMSO (Slightly), Methanol (Slightly, Heated), Pyridine (Slightly)
form  Solid
pka 12.71±0.70(Predicted)
color  Off-White
λmax 302nm(MeOH)(lit.)
BRN  63067
Stability Hygroscopic
InChIKey MGJLSBDCWOSMHL-JQQDRUSQSA-N
SMILES COc1ccc(cc1)C2=COc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc3C2=O
LogP 0.630 (est)
CAS DataBase Reference 486-62-4(CAS DataBase Reference)
FDA UNII Z0Z637970U
UNSPSC Code 41116107
NACRES NA.77

Safety

Symbol(GHS) Corrosion (GHS05)
Signal wordDanger
Hazard statements H314-H290
Precautionary statements P501-P260-P234-P264-P280-P390-P303+P361+P353-P301+P330+P331-P363-P304+P340+P310-P305+P351+P338+P310-P406-P405
Safety Statements  22-24/25
WGK Germany  3
HS Code  2938900000
Storage Class 11 - Combustible Solids

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