(2,4-Difluoro-3-(methoxycarbonyl)phenyl)boronic acid

Name: (2,4-Difluoro-3-(methoxycarbonyl)phenyl)boronic acid
Brand: ChemScene
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CAS No. 1190989-12-8
Cat. No. CS-0176096
Purity≥98%
MDL No.None

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(2,4-Difluoro-3-(methoxycarbonyl)phenyl)boronic acid|CS-0176096

Structure of 1190989-12-8

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Description

This boronic acid features a methoxycarbonyl group flanked by fluorine substituents, enhancing electronic modulation and stability. The ortho-fluorines facilitate oxidative stability and improve coupling efficiency in Suzuki-Miyaura reactions. This bench-stable reagent integrates readily into complex molecular architectures, enabling precise C–C bond formation under mild conditions.

Application

(2,4-Difluoro-3-(methoxycarbonyl)phenyl)boronic acid serves as a versatile building block in Suzuki-Miyaura cross-coupling reactions, enabling efficient construction of biaryl scaffolds with enhanced metabolic stability. Its fluorinated aryl core and ester-functionalized side chain provide excellent bench stability, predictable reactivity, and compatibility with diverse reaction conditions. The molecule facilitates the synthesis of complex heterocycles and pharmaceutically relevant frameworks, offering high functional group tolerance and straightforward purification via standard chromatographic methods.

General Information

CAS No. 1190989-12-8
Cat. No. CS-0176096
Purity ≥98%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₇BF₂O₄
Molecular Weight 215.95
Synonym(s) Methyl 3-borono-2,6-difluorobenzoate
SMILES COC(C1=C(F)C=CC(B(O)O)=C1F)=O

Computational Chemistry Data

TPSA 66.76
LogP -0.5688
H_Acceptors 4
H_Donors 2
Rotatable_Bonds 2

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 : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Other Classifications

Building Blocks Functional Group Boronic Acid And Its Ester

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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(2,4-Difluoro-3-(methoxycarbonyl)phenyl)boronic acid

CAS No. 1190989-12-8

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