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165806-53-1

Name SB 220025
CAS 165806-53-1
Molecular Formula C18H19FN6
MDL Number MFCD02179213
Molecular Weight 338.38
MOL File 165806-53-1.mol

Chemical Properties

Boiling point  611.9±65.0 °C(Predicted)
density  1.42±0.1 g/cm3(Predicted)
storage temp.  -20°C
solubility  DMSO: 22mg/mL
form  White to pale amber solid.
pka 9.92±0.10(Predicted)
color  white to pale yellow
InChI 1S/C18H19FN6/c19-13-3-1-12(2-4-13)16-17(15-7-10-22-18(20)24-15)25(11-23-16)14-5-8-21-9-6-14/h1-4,7,10-11,14,21H,5-6,8-9H2,(H2,20,22,24)
InChIKey VSPFURGQAYMVAN-UHFFFAOYSA-N
SMILES Fc1ccc(cc1)c2nc[n](c2c4nc(ncc4)N)C3CCNCC3

Safety Data

Symbol(GHS) 
GHS07,GHS06
Signal word  Danger
Hazard statements  H301-H319-H315-H335
Precautionary statements  P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P310-P321-P330-P405-P501
WGK Germany  WGK 1
Storage Class 11 - Combustible Solids

Hazard Information

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