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CS-W001157 4
Total: USD 88.00

4-(Oxetan-3-yl)aniline

  • CAS No. 1221819-62-0

  • Cat. No. CS-0160942
  • Purity≥95%
  • MDL No.MFCD20040419

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

4-(Oxetan-3-yl)aniline|CS-0160942

Structure of 1221819-62-0

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General Information

  • CAS No. 1221819-62-0
  • Cat. No. CS-0160942
  • Purity ≥95%
  • MDL No. MFCD20040419
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁NO
  • Molecular Weight 149.19
  • Synonym(s) 4-(3-OXETANYL)BENZENAMINE
  • SMILES NC1=CC=C(C2COC2)C=C1

Description

4-(Oxetan-3-yl)aniline features a reactive oxetane ring fused to an aromatic amine, enabling efficient bioconjugation and metabolic stabilization. This bench-stable, moisture-tolerant scaffold integrates seamlessly into drug discovery workflows, offering enhanced solubility and controlled reactivity for targeted molecular design.

Application

4-(Oxetan-3-yl)aniline serves as a versatile building block for medicinal chemistry and materials science, enabling efficient incorporation of the strained oxetane ring into biologically active scaffolds. The molecule combines a readily functionalizable aniline moiety with a highly reactive oxetanyl group, facilitating site-specific conjugation and cyclization reactions. Its bench-stable nature and compatibility with common coupling protocols make it suitable for modular synthesis workflows in API development.

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   35.25
  • LogP   1.3826
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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