2138882-71-8

Name KEA1-97
CAS 2138882-71-8
Molecular Formula C15H9Cl2FN4
MDL Number MFCD31697744
Molecular Weight 335.16
MOL File 2138882-71-8.mol
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Chemical Properties

Boiling point  530.3±52.0 °C(Predicted)
density  1.466±0.06 g/cm3(Predicted)
storage temp.  4°C, protect from light
solubility  DMSO : 100 mg/mL (298.36 mM; Need ultrasonic)
form  Solid
pka 0.57±0.10(Predicted)
color  White to light yellow
InChI InChI=1S/C15H9Cl2FN4/c16-13-20-14(17)22-15(21-13)19-12-7-3-10(4-8-12)9-1-5-11(18)6-2-9/h1-8H,(H,19,20,21,22)
InChIKey DUROVTLUQOYUPH-UHFFFAOYSA-N
SMILES N1=C(Cl)N=C(Cl)N=C1NC1=CC=C(C2=CC=C(F)C=C2)C=C1

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