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CS-W001157 4
Total: USD 88.00

3-(4-Bromophenyl)oxetane

  • CAS No. 1402158-49-9

  • Cat. No. CS-0051747
  • Purity≥96%
  • MDL No.None

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

3-(4-Bromophenyl)oxetane|CS-0051747

Structure of 1402158-49-9

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General Information

  • CAS No. 1402158-49-9
  • Cat. No. CS-0051747
  • Purity ≥96%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉BrO
  • Molecular Weight 213.07
  • Synonym(s) None
  • SMILES BrC1=CC=C(C=C1)C1COC1

Description

3-(4-Bromophenyl)oxetane features a brominated phenyl ring attached to a strained oxetane heterocycle, enabling efficient coupling reactions in medicinal chemistry. This bench-stable, moisture-tolerant building block integrates readily into bioactive scaffolds, offering enhanced solubility and metabolic stability for drug discovery applications.

Application

3-(4-Bromophenyl)oxetane serves as a versatile building block for constructing biaryl-containing heterocycles and pharmaceutical scaffolds. The bromine substituent enables palladium-catalyzed cross-coupling reactions, while the oxetane ring provides metabolic stability and improved solubility. This compound exhibits excellent bench stability and compatibility with standard reaction conditions, facilitating efficient incorporation into complex molecular architectures.

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-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   9.23
  • LogP   2.5629
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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