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CS-W001157 4
Total: USD 88.00

7-Bromo-2-(3-fluoro-4-hydroxyphenyl)-5-benzoxazolol

  • CAS No. 544704-73-6

  • Cat. No. CS-D0254
  • Purity≥98%
  • MDL No.MFCD22375515

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

7-Bromo-2-(3-fluoro-4-hydroxyphenyl)-5-benzoxazolol|CS-D0254

Structure of 544704-73-6

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General Information

  • CAS No. 544704-73-6
  • Cat. No. CS-D0254
  • Purity ≥98%
  • MDL No. MFCD22375515
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₇BrFNO₃
  • Molecular Weight 324.10
  • Synonym(s) 7-Bromo-2-(3-fluoro-4-hydroxyphenyl)benzo[d]oxazol-5-ol
  • SMILES BrC1=C2C(N=C(C3=CC=C(O)C(F)=C3)O2)=CC(O)=C1

Description

7-Bromo-2-(3-fluoro-4-hydroxyphenyl)-5-benzoxazolol features a brominated benzoxazole core paired with a fluorinated hydroxylated phenyl substituent, delivering enhanced electronic modulation and solubility. This scaffold integrates readily into bioactive molecule design, offering robust stability under standard conditions for synthetic and medicinal chemistry workflows.

Application

7-Bromo-2-(3-fluoro-4-hydroxyphenyl)-5-benzoxazolol serves as a versatile building block for the synthesis of functionalized benzoxazole scaffolds. The bromo group enables palladium-catalyzed cross-coupling reactions, while the phenolic hydroxyl supports derivatization and metal coordination. Its stability under standard reaction conditions facilitates purification and integration into complex molecular architectures relevant to medicinal chemistry and materials science.

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   66.49
  • LogP   3.8076
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   1

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