1928724-23-5

Name SK33
CAS 1928724-23-5
Molecular Formula C20H13F9N2O3
MDL Number MFCD32174353
Molecular Weight 500.31
MOL File 1928724-23-5.mol

Chemical Properties

Boiling point  540.5±50.0 °C(Predicted)
density  1.53±0.1 g/cm3(Predicted)
storage temp.  4°C, protect from light
solubility  DMSO : 100 mg/mL (199.88 mM; Need ultrasonic)
form  Solid
pka 12.12±0.29(Predicted)
color  White to off-white
InChI 1S/C20H13F9N2O3/c1-17(33,16(32)31-13-3-2-10(8-30)15(7-13)20(27,28)29)9-34-14-5-11(18(21,22)23)4-12(6-14)19(24,25)26/h2-7,33H,9H2,1H3,(H,31,32)
InChIKey VJIVKRQGSGBLFP-UHFFFAOYSA-N
SMILES OC(C(NC1=CC(C(F)(F)F)=C(C#N)C=C1)=O)(C)COC2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

Supplier