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256376-65-5

Name 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carbonitrile
CAS 256376-65-5
Molecular Formula C14H9FN4
MDL Number MFCD20268231
Molecular Weight 252.246
MOL File 256376-65-5.mol
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Chemical Properties

Melting point  80-82oC
Boiling point  454.2±40.0 °C(Predicted)
density  1.31±0.1 g/cm3(Predicted)
storage temp.  Sealed in dry,2-8°C
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 0.72±0.30(Predicted)
color  Yellow to Dark Yellow
InChI InChI=1S/C14H9FN4/c15-12-6-2-1-4-10(12)9-19-14-11(5-3-7-17-14)13(8-16)18-19/h1-7H,9H2
InChIKey CSUUGTRFBZTTQW-UHFFFAOYSA-N
SMILES C12N(CC3=CC=CC=C3F)N=C(C#N)C1=CC=CN=2

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302
Precautionary statements  P261-P280-P305+P351+P338-P304+P340

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