4110-15-0

Name 4-(1H-1,3-BENZODIAZOL-2-YL)BENZONITRILE
CAS 4110-15-0
Molecular Formula C14H9N3
MDL Number MFCD00511198
Molecular Weight 219.24
MOL File 4110-15-0.mol
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Chemical Properties

Melting point  230-234 °C
Boiling point  467.8±47.0 °C(Predicted)
density  1.31±0.1 g/cm3(Predicted)
form  solid
pka 10.96±0.10(Predicted)
InChI 1S/C14H9N3/c15-9-10-5-7-11(8-6-10)14-16-12-3-1-2-4-13(12)17-14/h1-8H,(H,16,17)
InChIKey INIBMZLOCLDDMA-UHFFFAOYSA-N
SMILES N#CC(C=C1)=CC=C1C2=NC3=CC=CC=C3N2

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Dam. 1

Hazard Information

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