(2-Methyl-2H-1,2,3-triazol-4-yl)boronic acid

Name: (2-Methyl-2H-1,2,3-triazol-4-yl)boronic acid
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CAS No. 1372713-72-8
Cat. No. CS-0096939
Purity≥98%
MDL No.None

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(2-Methyl-2H-1,2,3-triazol-4-yl)boronic acid|CS-0096939

Structure of 1372713-72-8

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General Information

CAS No. 1372713-72-8
Cat. No. CS-0096939
Purity ≥98%
MDL No. None
Storage -20°C, sealed storage, away from moisture
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₃H₆BN₃O₂
Molecular Weight 126.91
Synonym(s) None
SMILES OB(C1=NN(C)N=C1)O

Description

This boronate moiety features a methyl-substituted triazole scaffold, delivering enhanced stability and solubility in polar solvents. The electron-deficient triazolyl group facilitates efficient Suzuki-Miyaura coupling under mild conditions, enabling direct functionalization of aryl halides without requiring additional ligands.

Application

(2-Methyl-2H-1,2,3-triazol-4-yl)boronic acid serves as a stable, bench-compatible building block for Suzuki-Miyaura cross-coupling reactions. Its triazolylboronic acid functionality enables efficient C–C bond formation with aryl and heteroaryl halides under mild conditions, offering excellent functional group tolerance and straightforward purification. This reagent functions as a key scaffold in the synthesis of triazole-containing bioactive molecules and advanced heterocyclic systems.

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
Precautionary Statements : P264-P270-P280-P302+P352-P330-P362+P364-P501

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Computational Chemistry Data

TPSA 71.17
LogP -2.5051
H_Acceptors 5
H_Donors 2
Rotatable_Bonds 1

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Triazole compounds

Key Words

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(2-Methyl-2H-1,2,3-triazol-4-yl)boronic acid

CAS No. 1372713-72-8

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