1638211-04-7

Name 2-Methoxy-4-(3-methyl-1-(4-(trifluoromethyl)phenyl)-1H-pyrazolo[3,4-b]pyridin-4-yl)phenol
CAS 1638211-04-7
Molecular Formula C21H16F3N3O2
MDL Number MFCD28168046
Molecular Weight 399.37
MOL File 1638211-04-7.mol
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Chemical Properties

Boiling point  483.6±45.0 °C(Predicted)
density  1.36±0.1 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DMSO: 20mg/mL, clear
form  powder
pka 8.01±0.20(Predicted)
color  white to beige
InChI 1S/C21H16F3N3O2/c1-12-19-16(13-3-8-17(28)18(11-13)29-2)9-10-25-20(19)27(26-12)15-6-4-14(5-7-15)21(22,23)24/h3-11,28H,1-2H3
InChIKey YBRHGNCGFMRGSV-UHFFFAOYSA-N
SMILES CC1=NN(C2=CC=C(C(F)(F)F)C=C2)C3=NC=CC(C4=CC=C(O)C(OC)=C4)=C31

Safety Data

Symbol(GHS)  Skull and Crossbones (GHS06)
GHS06
Signal word  Danger
Hazard statements  H301
Precautionary statements  P301+P310
Hazard Codes  T
Risk Statements 
Safety Statements 
RIDADR  UN 2811 6.1 / PGIII
WGK Germany  WGK 3
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral

Hazard Information

Spectrum Detail

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