6-Bromo-1,2-benzisoxazole

Name: 6-Bromo-1,2-benzisoxazole
Brand: ChemScene
Availability: InStock
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CAS No. 1060802-88-1
Cat. No. CS-W005194
Purity≥95%
MDL No.MFCD06659634

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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 1060802-88-1

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Description

6-Bromo-1,2-benzisoxazole serves as a valuable heterocyclic scaffold in medicinal chemistry and synthetic methodology. This bench-stable, electron-deficient ring system integrates readily into pharmaceutical intermediates and functional materials. The bromine substituent enables direct coupling reactions, facilitating the construction of complex architectures through palladium-catalyzed cross-couplings.

Application

6-Bromo-1,2-benzisoxazole serves as a versatile building block in medicinal chemistry and synthetic organic chemistry, enabling efficient access to functionalized heterocyclic scaffolds. Its bromine substituent facilitates palladium-catalyzed cross-coupling reactions, including Suzuki and Stille couplings, with high reliability. The benzisoxazole core exhibits excellent bench stability and compatibility with diverse reaction conditions, supporting the construction of complex molecular architectures relevant to drug discovery programs.

General Information

CAS No. 1060802-88-1
Cat. No. CS-W005194
Purity ≥95%
MDL No. MFCD06659634
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₄BrNO
Molecular Weight 198.02
Synonym(s) 6-broMobenzo[d]isoxazole
SMILES BrC2=CC1=C(C=NO1)C=C2

Computational Chemistry Data

TPSA 26.03
LogP 2.5903
H_Acceptors 2
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

Quality Control

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Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Benzoisoxazole compounds

Key Words

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6-Bromo-1,2-benzisoxazole

CAS No. 1060802-88-1

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