Identification Chemical Properties Safety Data Hazard Information Supplier

1801343-74-7

Name CA-4948
CAS 1801343-74-7
Molecular Formula C21H19N7O3
Molecular Weight 417.42
MOL File 1801343-74-7.mol
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Chemical Properties

Melting point  >294°C (dec.)
density  1.444±0.06 g/cm3(Predicted)
storage temp.  -20°C Freezer, Under inert atmosphere
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 10.41±0.43(Predicted)
color  Pale Yellow to Brown
InChI InChI=1S/C21H19N7O3/c22-18-5-4-13(11-23-18)15-2-1-3-16(26-15)20(29)25-14-10-17-19(24-12-14)27-21(31-17)28-6-8-30-9-7-28/h1-5,10-12H,6-9H2,(H2,22,23)(H,25,29)
InChIKey RWIMETUXCNDSLE-UHFFFAOYSA-N
SMILES C1(C2=CC=C(N)N=C2)=NC(C(NC2=CN=C3N=C(N4CCOCC4)OC3=C2)=O)=CC=C1

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338

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