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39011-91-1

Name oxypaeoniflora
CAS 39011-91-1
Molecular Formula C23H28O12
MDL Number MFCD00869478
Molecular Weight 496.462
MOL File 39011-91-1.mol
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Chemical Properties

Melting point  >162°C (dec.)
Boiling point  737.1±60.0 °C(Predicted)
density  1.71±0.1 g/cm3(Predicted)
storage temp.  Hygroscopic, -20°C Freezer, Under inert atmosphere
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 8.16±0.15(Predicted)
color  White to Pale Yellow
Stability: Hygroscopic
InChIKey FCHVXNVDFYXLIL-UHFFFAOYSA-N
SMILES [H][C@]12O[C@]3(C)C4(O[C@@]5([H])[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O5)[C@@]1(COC(C6=CC=C(O)C=C6)=O)[C@@]([H])(C4)[C@@](O)(C3)O2

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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