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666837-93-0

Name SU 9516
CAS 666837-93-0
Molecular Formula C13H11N3O2
MDL Number MFCD17010284
Molecular Weight 241.25
MOL File 666837-93-0.mol
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Chemical Properties

Boiling point  601.5±55.0 °C(Predicted)
density  1.383±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DMSO: ~17 mg/mL
form  crystalline
pka 11?+-.0.20(Predicted)
color  brown
InChI 1S/C13H11N3O2/c1-18-9-2-3-12-10(5-9)11(13(17)16-12)4-8-6-14-7-15-8/h2-7H,1H3,(H,14,15)(H,16,17)
InChIKey QNUKRWAIZMBVCU-UHFFFAOYSA-N
SMILES [nH]1cncc1C=C2c3c(ccc(c3)OC)NC2=O

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338
Safety Statements 
WGK Germany  3
Storage Class 11 - Combustible Solids

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