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CS-W001157 4
Total: USD 88.00

4,7-Dibromobenzo[c][1,2,5]oxadiazole

  • CAS No. 54286-63-4

  • Cat. No. CS-0097774
  • Purity≥96%
  • MDL No.MFCD02114623

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

4,7-Dibromobenzo[c][1,2,5]oxadiazole|CS-0097774

Structure of 54286-63-4

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General Information

  • CAS No. 54286-63-4
  • Cat. No. CS-0097774
  • Purity ≥96%
  • MDL No. MFCD02114623
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₂Br₂N₂O
  • Molecular Weight 277.90
  • Synonym(s) 4,7-Dibromobenzofurazan
  • SMILES BrC1=CC=C(Br)C2=NON=C21

Description

4,7-Dibromobenzo[c][1,2,5]oxadiazole is a brominated heterocyclic scaffold featuring two strategically positioned bromine atoms on a benzo-bridged oxadiazole core. This configuration enables efficient coupling in cross-coupling reactions, delivering functionalized aromatic systems with enhanced stability and controlled electronic properties for advanced materials and pharmaceutical synthesis.

Application

4,7-Dibromobenzo[c][1,2,5]oxadiazole serves as a versatile dibromo building block for transition-metal-catalyzed cross-coupling reactions. Its ortho-brominated oxadiazole core exhibits excellent bench stability and functional group tolerance, enabling efficient construction of complex heteroaromatic scaffolds. The molecule functions as a key intermediate in the synthesis of conjugated materials and bioactive compounds, facilitating direct C–C bond formation under standard palladium-catalyzed conditions.

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   38.92
  • LogP   2.7478
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   0

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