1129669-05-1

Name IM-12
CAS 1129669-05-1
Molecular Formula C22H20FN3O2
MDL Number MFCD20527313
Molecular Weight 377.412
MOL File 1129669-05-1.mol

Chemical Properties

Melting point  187 °C
Boiling point  600.2±55.0 °C(Predicted)
density  1.34±0.1 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DMSO: ≥9mg/mL
form  powder
pka 16.77±0.30(Predicted)
color  yellow-orange
InChI 1S/C22H20FN3O2/c1-13-18(16-5-3-4-6-17(16)25-13)19-20(22(28)26(2)21(19)27)24-12-11-14-7-9-15(23)10-8-14/h3-10,24-25H,11-12H2,1-2H3
InChIKey ZKJAZFUFPPSFCO-UHFFFAOYSA-N
SMILES CN1C(=O)C(NCCc2ccc(F)cc2)=C(C1=O)c3c(C)[nH]c4ccccc34

Safety Data

Hazard Codes  Xn
Risk Statements 
WGK Germany  3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

Supplier