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CS-W001157 4
Total: USD 88.00

4-Bromobenzo[d]oxazole

  • CAS No. 217326-65-3

  • Cat. No. CS-0029703
  • Purity≥98%
  • MDL No.MFCD08234620

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

4-Bromobenzo[d]oxazole|CS-0029703

Structure of 217326-65-3

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General Information

  • CAS No. 217326-65-3
  • Cat. No. CS-0029703
  • Purity ≥98%
  • MDL No. MFCD08234620
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄BrNO
  • Molecular Weight 198.02
  • Synonym(s) 4-Bromobenzo[d]oxazole
  • SMILES BrC1=C2N=COC2=CC=C1

Description

4-Bromobenzo[d]oxazole is a heterocyclic bromoarene featuring a fused benzene-oxazole core, offering enhanced stability and predictable reactivity in cross-coupling transformations. This bench-stable compound integrates readily into complex molecular architectures via palladium-catalyzed reactions, serving as a valuable scaffold for pharmaceutical and materials development.

Application

4-Bromobenzo[d]oxazole serves as a versatile building block in medicinal chemistry and materials science, enabling palladium-catalyzed cross-coupling reactions due to its stable bromine substituent. Its fused heterocyclic structure provides enhanced metabolic stability and rigidity, making it valuable for constructing bioactive scaffolds. The compound exhibits excellent bench stability, ease of handling, and compatibility with common reaction conditions, facilitating efficient synthesis of complex architectures.

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   26.03
  • LogP   2.5903
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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