2-AMINO-5-BROMOBENZONITRILE Chemical Properties

Melting point:

96-100 °C(lit.)

Boiling point:

288.4±25.0 °C(Predicted)

Density 

1.6480 (rough estimate)

refractive index 

1.5500 (estimate)

storage temp. 

Keep in dark place,Inert atmosphere,Room temperature

solubility 

Soluble in methanol.

pka

1.11±0.10(Predicted)

form 

Crystalline Powder

color 

Off-white to pale brown

InChI

InChI=1S/C7H5BrN2/c8-6-1-2-7(10)5(3-6)4-9/h1-3H,10H2

InChIKey

OATYCBHROMXWJO-UHFFFAOYSA-N

SMILES

C(#N)C1=CC(Br)=CC=C1N

CAS DataBase Reference

39263-32-6(CAS DataBase Reference)

Safety Information

Hazard Codes 

Xn,Xi

Risk Statements 

20/21/22-43-36/37/38

Safety Statements 

36/37-36/37/39-26-22

RIDADR 

3439

WGK Germany 

3

Hazard Note 

Irritant

HazardClass 

6.1

PackingGroup 

III

HS Code 

29269090

MSDS

• Language:English Provider:ACROS
• Language:English Provider:SigmaAldrich

2-AMINO-5-BROMOBENZONITRILE Usage And Synthesis

Description

2-Amino-5-bromo-benzonitrile is a heterocyclic building block. It has been used in the synthesis of copper-ligand coordination complexes and 4-amino-3-benzimidazol-2-ylhydroquinolin-2-one-based multi-targeted receptor tyrosine kinase (RTK) inhibitors with anticancer activity.

Chemical Properties

white to light yellow crystal powder

Uses

2-Amino-5-bromobenzonitrile can react with Oxalic acid dimethyl ester to get 5-Bromo-N-methylanthranilonitrile.

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