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CS-W001157 4
Total: USD 88.00

(2-(Azetidin-1-yl)pyrimidin-5-yl)boronic acid

  • CAS No. 1411643-59-8

  • Cat. No. CS-W006335
  • Molecule weight178.98
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

(2-(Azetidin-1-yl)pyrimidin-5-yl)boronic acid|CS-W006335

Structure of 1411643-59-8

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General Information

  • CAS No. 1411643-59-8
  • Cat. No. CS-W006335
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₀BN₃O₂
  • Molecular Weight 178.98
  • Synonym(s) [2-(1-Azetidinyl)-5-pyrimidinyl]borsäure
  • SMILES OB(C1=CN=C(N2CCC2)N=C1)O

Description

This boronate moiety integrates a pyrimidine core with an azetidinyl substituent, delivering enhanced solubility and stability. The strained azetidine ring imparts unique reactivity, enabling efficient coupling in Suzuki-Miyaura transformations under mild conditions.

Application

(2-(Azetidin-1-yl)pyrimidin-5-yl)boronic acid serves as a versatile building block in medicinal chemistry, enabling palladium-catalyzed cross-coupling reactions to construct biologically relevant pyrimidine scaffolds. The boronic acid moiety facilitates efficient Suzuki-Miyaura coupling with aryl and heteroaryl halides, while the azetidinyl substituent provides enhanced solubility and metabolic stability. Bench-stable and readily purified by flash chromatography, it functions effectively in late-stage functionalization and API synthesis workflows.

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

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Computational Chemistry Data

  • TPSA   69.48
  • LogP   -1.6335
  • H_Acceptors   5
  • H_Donors   2
  • Rotatable_Bonds   2

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