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CS-W001157 4
Total: USD 88.00

4-Bromobenzothiazole

  • CAS No. 767-68-0

  • Cat. No. CS-W005649
  • Purity≥98%
  • MDL No.MFCD11858590

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

4-Bromobenzothiazole|CS-W005649

Structure of 767-68-0

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General Information

  • CAS No. 767-68-0
  • Cat. No. CS-W005649
  • Purity ≥98%
  • MDL No. MFCD11858590
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄BrNS
  • Molecular Weight 214.08
  • Synonym(s) Benzothiazole, 4-bromo- (7CI,8CI) USP
  • SMILES BrC1=CC=CC2=C1N=CS2

Description

4-Bromobenzothiazole is a bench-stable heterocyclic compound featuring a bromine atom at the para position relative to the thiazole nitrogen. This electron-deficient scaffold integrates readily into cross-coupling reactions, serving as a valuable building block for pharmaceutical intermediates and functional materials.

Application

4-Bromobenzothiazole serves as a versatile building block in medicinal chemistry and materials science, enabling palladium-catalyzed cross-coupling reactions such as Suzuki, Stille, and Negishi couplings. Its bromine substituent offers high reactivity under standard conditions, while the benzothiazole core provides robust stability and favorable electronic properties. The compound functions as a key scaffold for heterocyclic synthesis and is widely used in the development of pharmaceutical intermediates and functional organic materials.

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   12.89
  • LogP   3.0588
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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