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CS-W001157 4
Total: USD 88.00

Benzo[d]isoxazol-3-amine

  • CAS No. 36216-80-5

  • Cat. No. CS-W009278
  • Purity≥97%
  • MDL No.MFCD03407353

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

Benzo[d]isoxazol-3-amine|CS-W009278

Structure of 36216-80-5

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General Information

  • CAS No. 36216-80-5
  • Cat. No. CS-W009278
  • Purity ≥97%
  • MDL No. MFCD03407353
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆N₂O
  • Molecular Weight None
  • Synonym(s) 3-Amino-1,2-benzisoxazole; 3-Aminobenzisoxazole; Benzo[d]isoxazol-3-amine; Benzo[d]isoxazol-3-ylamine; 1,2-Benzisoxazol-3-amine
  • SMILES NC1=NOC2=C1C=CC=C2

Description

Benzo[d]isoxazol-3-amine features a fused bicyclic core with a strategically positioned amine group, enabling direct functionalization in synthetic routes. This electron-rich heterocycle offers enhanced reactivity in cross-coupling and cyclization processes, serving as a key scaffold in medicinal chemistry. The compound demonstrates robust stability under standard bench conditions and integrates readily into complex molecular architectures.

Application

Benzo[d]isoxazol-3-amine serves as a versatile heterocyclic building block in medicinal chemistry, enabling efficient access to bioactive scaffolds through established functionalization protocols. Its ortho-amino functionality facilitates direct coupling reactions and transition-metal-catalyzed transformations, while the fused isoxazole core offers enhanced metabolic stability. The compound exhibits excellent bench stability and compatibility with common protecting group strategies, supporting scalable synthesis of complex molecular 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   52.05
  • LogP   1.41
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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