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CS-W001157 4
Total: USD 88.00

3,5-Dimethylisoxazol-4-amine

  • CAS No. 31329-64-3

  • Cat. No. CS-W008258
  • Purity≥98%
  • MDL No.MFCD02681972

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

3,5-Dimethylisoxazol-4-amine|CS-W008258

Structure of 31329-64-3

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General Information

  • CAS No. 31329-64-3
  • Cat. No. CS-W008258
  • Purity ≥98%
  • MDL No. MFCD02681972
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₈N₂O
  • Molecular Weight 112.13
  • Synonym(s) TIMTEC-BB SBB005896
  • SMILES NC1=C(C)ON=C1C

Description

3,5-Dimethylisoxazol-4-amine features a sterically hindered isoxazole core with two methyl groups stabilizing the nitrogen lone pair. This bench-stable heterocycle serves as a selective scaffold for bioactive molecule design, particularly in kinase inhibitor and CNS-targeted compound development. The amine functionality enables direct coupling or derivatization under standard conditions.

Application

3,5-Dimethylisoxazol-4-amine serves as a versatile heterocyclic building block in medicinal chemistry, enabling rapid access to bioactive scaffolds through standard coupling and functionalization reactions. Its stability under ambient conditions and compatibility with diverse reaction types facilitate efficient synthesis of target molecules. The molecule's defined regiochemistry and predictable reactivity make it ideal for constructing isoxazole-based pharmacophores with enhanced metabolic profile.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501

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Computational Chemistry Data

  • TPSA   52.05
  • LogP   0.87364
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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