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384859-58-9

Name BCH001
CAS 384859-58-9
Molecular Formula C20H15F3N2O5
MDL Number MFCD02932975
Molecular Weight 420.34
MOL File 384859-58-9.mol
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Chemical Properties

Boiling point  494.3±45.0 °C(Predicted)
density  1.448±0.06 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  DMSO : 125 mg/mL (297.38 mM; Need ultrasonic)
form  Solid
pka 3.39±0.36(Predicted)
color  White to yellow
InChI InChI=1S/C20H15F3N2O5/c1-2-29-19(28)14-10-24-15-8-7-11(30-20(21,22)23)9-13(15)17(14)25-16-6-4-3-5-12(16)18(26)27/h3-10H,2H2,1H3,(H,24,25)(H,26,27)
InChIKey FWJMVZAVAUGMDX-UHFFFAOYSA-N
SMILES N1C2C(=CC(OC(F)(F)F)=CC=2)C(NC2=CC=CC=C2C(O)=O)=C(C(OCC)=O)C=1

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P280-P301+P312-P302+P352-P305+P351+P338

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