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CS-W001157 4
Total: USD 88.00

(4-(Oxetan-3-yl)phenyl)boronic acid

  • CAS No. 1417887-72-9

  • Cat. No. CS-0197877
  • Purity≥95%
  • MDL No.MFCD20923620

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

(4-(Oxetan-3-yl)phenyl)boronic acid|CS-0197877

Structure of 1417887-72-9

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General Information

  • CAS No. 1417887-72-9
  • Cat. No. CS-0197877
  • Purity ≥95%
  • MDL No. MFCD20923620
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁BO₃
  • Molecular Weight 177.99
  • Synonym(s) None
  • SMILES OB(C1=CC=C(C2COC2)C=C1)O

Description

This oxetane-containing boronic acid integrates a strained four-membered ring that enhances reactivity in Suzuki-Miyaura coupling while maintaining bench stability. The arylboronic moiety enables efficient cross-coupling under mild conditions, and the oxetan-3-yl group improves solubility and metabolic stability in bioactive molecule synthesis.

Application

(4-(Oxetan-3-yl)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. The oxetane ring imparts favorable physicochemical properties, including improved solubility and reduced lipophilicity, while the boronic acid functionality offers excellent bench stability and compatibility with diverse reaction conditions. Its functional group tolerance facilitates integration into complex molecular architectures common in medicinal chemistry and API development.

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

Quality Control

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Computational Chemistry Data

  • TPSA   49.69
  • LogP   -0.5198
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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