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5-Bromo-3-nitropyridine-2-carbonitrile Structure

5-Bromo-3-nitropyridine-2-carbonitrile

Chemical Properties

Melting point 101-106 °C
Boiling point 348.9±42.0 °C(Predicted)
Density  1.92±0.1 g/cm3(Predicted)
storage temp.  Inert atmosphere,Room Temperature
form  powder to crystal
pka -6.71±0.20(Predicted)
color  Light orange to Yellow to Green
InChI InChI=1S/C6H2BrN3O2/c7-4-1-6(10(11)12)5(2-8)9-3-4/h1,3H
InChIKey OBVYONPVHIOJJZ-UHFFFAOYSA-N
SMILES C1(C#N)=NC=C(Br)C=C1[N+]([O-])=O
CAS DataBase Reference 573675-25-9(CAS DataBase Reference)

Safety Information

Hazard Codes  T,Xi
Risk Statements  20/21-25-37/38-41
Safety Statements  26-36/37/39-45
RIDADR  UN 2811 6.1/PG 3
WGK Germany  3
Hazard Note  Toxic
HazardClass  IRRITANT
PackingGroup 
HS Code  29333990
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral
Eye Dam. 1
Skin Irrit. 2
STOT SE 3

Usage And Synthesis

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