582323-16-8

Name ICA 069673
CAS 582323-16-8
Molecular Formula C11H6ClF2N3O
MDL Number MFCD20926351
Molecular Weight 269.63
MOL File 582323-16-8.mol

Chemical Properties

Boiling point  358.9±37.0 °C(Predicted)
density  1.539±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
solubility  DNF:30.0(Max Conc. mg/mL);111.26(Max Conc. mM)
DMSO:36.24(Max Conc. mg/mL);134.4(Max Conc. mM)
Ethanol:30.25(Max Conc. mg/mL);112.18(Max Conc. mM)
form  Powder
pka 9.47±0.70(Predicted)
color  White to off-white
InChI 1S/C11H6ClF2N3O/c12-11-15-4-7(5-16-11)17-10(18)6-1-2-8(13)9(14)3-6/h1-5H,(H,17,18)
InChIKey IIBSHMFXVWTQSJ-UHFFFAOYSA-N
SMILES O=C(C1=CC=C(F)C(F)=C1)NC2=CN=C(Cl)N=C2

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Supplier