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CM-4620 Structure

CM-4620

Chemical Properties

Boiling point 444.4±45.0 °C(Predicted)
Density  1.58±0.1 g/cm3(Predicted)
storage temp.  Store at -20°C
solubility  DMSO : ≥ 100 mg/mL (237.10 mM);Water : < 0.1 mg/mL (insoluble)
pka 10.06±0.70(Predicted)
form  Solid
color  White to off-white
InChI InChI=1S/C19H11ClF3N3O3/c1-9-3-2-4-12(21)17(9)18(27)26-16-8-24-13(7-25-16)10-5-14-15(6-11(10)20)29-19(22,23)28-14/h2-8H,1H3,(H,25,26,27)
InChIKey QQMKTHUGOQDEIL-UHFFFAOYSA-N
SMILES C(NC1=NC=C(C2=C(Cl)C=C3OC(F)(F)OC3=C2)N=C1)(=O)C1=C(C)C=CC=C1F

Usage And Synthesis

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