(3-Bromo-4-fluorophenyl)boronic acid

Name: (3-Bromo-4-fluorophenyl)boronic acid
Brand: ChemScene
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CAS No. 1092533-91-9
Cat. No. CS-0113023
Purity≥97%
MDL No.MFCD13195642

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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(3-Bromo-4-fluorophenyl)boronic acid|CS-0113023

Structure of 1092533-91-9

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General Information

CAS No. 1092533-91-9
Cat. No. CS-0113023
Purity ≥97%
MDL No. MFCD13195642
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₅BBrFO₂
Molecular Weight 218.82
Synonym(s) 3-Bromo-4-fluorophenylboronic acid
SMILES BrC1=CC(B(O)O)=CC=C1F

Description

This boronate moiety enables direct coupling in Suzuki-Miyaura reactions, delivering arylated products with high fidelity. The para-fluorine and ortho-bromo substituents provide complementary reactivity for sequential functionalization, while the bench-stable nature simplifies handling under standard conditions.

Application

(3-Bromo-4-fluorophenyl)boronic acid serves as a versatile building block in palladium-catalyzed cross-coupling reactions, enabling efficient C–C bond formation under standard Suzuki-Miyaura conditions. The molecule combines ortho-halogen substitution with a stable boronic acid group, offering predictable reactivity and compatibility with diverse functional groups. Its bench-stable nature and ease of purification make it well-suited for iterative synthesis in medicinal chemistry and materials science applications.

Safety Information

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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-P280-P302+P352

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Computational Chemistry Data

TPSA 40.46
LogP 0.268
H_Acceptors 2
H_Donors 2
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Boronic Acid And Its Ester

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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(3-Bromo-4-fluorophenyl)boronic acid

CAS No. 1092533-91-9

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