1852-50-2

Name Estriol-16beta-D-glucopyranosiduronic acid
CAS 1852-50-2
Molecular Formula C24H32O9
MDL Number MFCD00056554
Molecular Weight 464.51
MOL File 1852-50-2.mol

Chemical Properties

Boiling point  738.3±60.0 °C(Predicted)
density  1.51±0.1 g/cm3(Predicted)
storage temp.  −20°C
solubility  ethanol: water (1:1): 10mg/mL, clear to very slightly hazy, colorless
form  powder
pka 2.82±0.70(Predicted)
BRN  67674
InChIKey FQYGGFDZJFIDPU-JRSYHJKYSA-N
SMILES [H][C@]12CC[C@]3(C)[C@@H](O)[C@@H](C[C@@]3([H])[C@]1([H])CCc4cc(O)ccc24)O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(O)=O

Safety Data

Symbol(GHS)  Health Hazard (GHS08)
GHS08
Signal word  Warning
Hazard statements  H351
Precautionary statements  P281
Hazard Codes  Xn
Risk Statements 
Safety Statements 
WGK Germany  3
F  3-10
Storage Class 11 - Combustible Solids
Hazard Classifications Carc. 2

Hazard Information

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