2,6-Dibromobenzonitrile

Name: 2,6-Dibromobenzonitrile
Brand: ChemScene
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CAS No. 6575-12-8
Cat. No. CS-0097910
Purity≥98%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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Structure of 6575-12-8

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Description

2,6-Dibromobenzonitrile features a nitrile group flanked by bromine substituents at the 2 and 6 positions, creating a highly electron-deficient aromatic core. This configuration enables direct functionalization in cross-coupling reactions, particularly under palladium catalysis. The compound exhibits excellent stability under standard conditions and serves as a robust building block for synthesizing advanced pharmaceutical intermediates and functionalized materials.

Application

2,6-Dibromobenzonitrile serves as a versatile building block in synthetic organic chemistry, enabling palladium-catalyzed cross-coupling reactions due to its orthogonal reactivity profile. The nitrile group provides a handle for further functionalization, while the bromine substituents facilitate Suzuki, Stille, and Negishi couplings under standard conditions. Its bench-stable nature and compatibility with diverse reaction environments make it well-suited for constructing complex aromatic scaffolds in medicinal chemistry and materials science applications.

General Information

CAS No. 6575-12-8
Cat. No. CS-0097910
Purity ≥98%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₃Br₂N
Molecular Weight 260.91
Synonym(s) 2,6-dibromo-benzonitrile
SMILES N#CC1=C(C=CC=C1Br)Br

Computational Chemistry Data

TPSA 23.79
LogP 3.08328
H_Acceptors 1
H_Donors 0
Rotatable_Bonds 0

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2,6-Dibromobenzonitrile

CAS No. 6575-12-8

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