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CS-W001157 4
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4-Bromoisoxazol-3-amine

  • CAS No. 1519318-68-3

  • Cat. No. CS-0186966
  • Purity≥96%
  • MDL No.None

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

4-Bromoisoxazol-3-amine|CS-0186966

Structure of 1519318-68-3

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General Information

  • CAS No. 1519318-68-3
  • Cat. No. CS-0186966
  • Purity ≥96%
  • MDL No. None
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃H₃BrN₂O
  • Molecular Weight 162.97
  • Synonym(s) 4-Bromo-1,2-oxazol-3-amine
  • SMILES BrC1=CON=C1N

Description

4-Bromoisoxazol-3-amine features a brominated isoxazole core with a pendant amine group, enabling direct incorporation into diverse heterocyclic scaffolds. This bench-stable, moisture-tolerant building block facilitates efficient access to bioactive compounds through cross-coupling and cyclization strategies.

Application

4-Bromoisoxazol-3-amine serves as a versatile building block in medicinal chemistry, enabling the construction of isoxazole-based scaffolds through palladium-catalyzed cross-coupling reactions. Its bromine handle facilitates efficient functionalization via Suzuki, Stille, or Negishi transformations, while the pendant amine group offers orthogonal reactivity for derivatization. The compound exhibits good bench stability and compatibility with standard purification methods, making it well-suited for iterative synthesis campaigns targeting bioactive heterocycles.

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   52.05
  • LogP   1.0193
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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