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330792-70-6

Name 5-aMino-3-(4-phenoxyphenyl)-1H-pyrazole-4-carbonitrile
CAS 330792-70-6
EINECS(EC#) 805-642-2
Molecular Formula C16H12N4O
MDL Number MFCD20270361
Molecular Weight 276.293
MOL File 330792-70-6.mol

Chemical Properties

Boiling point  585.3±50.0 °C(Predicted)
density  1.37±0.1 g/cm3(Predicted)
refractive index  1.699
Fp  307.8℃
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
solubility  DMSO (Slightly)
pka 10.83±0.50(Predicted)
InChI InChI=1S/C16H12N4O/c17-10-14-15(19-20-16(14)18)11-6-8-13(9-7-11)21-12-4-2-1-3-5-12/h1-9H,(H3,18,19,20)
InChIKey HNIMEQCLCNSCGH-UHFFFAOYSA-N
SMILES N1C(C2=CC=C(OC3=CC=CC=C3)C=C2)=C(C#N)C(N)=N1
LogP 3.25298

Safety Data

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

Hazard Information

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