3-Bromo-2-chlorophenol

Name: 3-Bromo-2-chlorophenol
Brand: ChemScene
Availability: InStock
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CAS No. 863870-87-5
Cat. No. CS-W019088
Purity≥98%
MDL No.MFCD08166321

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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 863870-87-5

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Description

3-Bromo-2-chlorophenol features a bromine substituent at the meta position and a chlorine atom at the ortho position relative to the hydroxyl group, creating a uniquely activated aromatic scaffold. This electron-deficient phenolic system facilitates selective coupling reactions in synthetic organic chemistry, particularly in palladium-catalyzed cross-couplings. The compound exhibits enhanced stability under standard bench conditions and integrates readily into complex molecular architectures requiring halogen-directed functionalization.

Application

3-Bromo-2-chlorophenol serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling direct functionalization at the ortho position relative to the phenolic hydroxyl group. Its dual halogen substituents facilitate palladium-catalyzed cross-coupling reactions, including Suzuki-Miyaura and Stille couplings, with high regioselectivity. The compound exhibits excellent bench stability and ease of purification, making it well-suited for multi-step syntheses requiring robust intermediates.

General Information

CAS No. 863870-87-5
Cat. No. CS-W019088
Purity ≥98%
MDL No. MFCD08166321
Storage RT, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₄BrClO
Molecular Weight None
Synonym(s) None
SMILES OC1=C(Cl)C(Br)=CC=C1

Computational Chemistry Data

TPSA 20.23
LogP 2.8081
H_Acceptors 1
H_Donors 1
Rotatable_Bonds 0

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS05,GHS07
Signal Word : Danger	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H318-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 Functional Group Chloride

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-Bromo-2-chlorophenol

CAS No. 863870-87-5

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