2-Amino-4-bromobenzonitrile

Name: 2-Amino-4-bromobenzonitrile
Brand: ChemScene
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CAS No. 304858-65-9
Cat. No. CS-W004831
Purity≥98%
MDL No.MFCD08752638

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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 304858-65-9

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Description

2-Amino-4-bromobenzonitrile features a bromine substituent and nitrile group flanking a primary amine on a benzene ring, enabling direct coupling in cross-coupling reactions. This electron-deficient scaffold integrates readily into pharmaceutical intermediates and functional materials under standard conditions.

Application

2-Amino-4-bromobenzonitrile serves as a versatile building block in medicinal chemistry and materials science, enabling efficient access to functionalized heterocycles via Pd-catalyzed cross-coupling and cyclization reactions. The ortho-amino and bromo groups provide orthogonal reactivity for sequential functionalization, while the nitrile group offers compatibility with standard transformations. Bench-stable and readily purified by recrystallization, it facilitates scalable synthesis of advanced intermediates for API development.

General Information

CAS No. 304858-65-9
Cat. No. CS-W004831
Purity ≥98%
MDL No. MFCD08752638
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₅BrN₂
Molecular Weight 197.03
Synonym(s) Amino-4-bromobenzonitrile
SMILES NC1=C(C#N)C=CC(=C1)Br

Computational Chemistry Data

TPSA 49.81
LogP 1.90298
H_Acceptors 2
H_Donors 1
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 Cyanide/Nitrile

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2-Amino-4-bromobenzonitrile

CAS No. 304858-65-9

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