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CS-W001157 4
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3-(Oxazol-5-yl)aniline

  • CAS No. 157837-31-5

  • Cat. No. CS-0067855
  • Purity≥98%
  • MDL No.MFCD00052191

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

3-(Oxazol-5-yl)aniline|CS-0067855

Structure of 157837-31-5

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General Information

  • CAS No. 157837-31-5
  • Cat. No. CS-0067855
  • Purity ≥98%
  • MDL No. MFCD00052191
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈N₂O
  • Molecular Weight 160.17
  • Synonym(s) 3-(5-Oxazolyl)aniline
  • SMILES NC1=CC=CC(C2=CN=CO2)=C1

Description

3-(Oxazol-5-yl)aniline integrates a polar oxazolyl heterocycle with an aromatic amine, enabling versatile coupling in medicinal chemistry. This bench-stable scaffold features enhanced solubility and directional reactivity, facilitating efficient access to functionalized biaryl architectures under standard conditions.

Application

3-(Oxazol-5-yl)aniline serves as a versatile building block for heterocyclic synthesis, enabling efficient access to biologically relevant scaffolds. Its ortho-substituted aniline functionality facilitates direct coupling reactions and electrophilic aromatic substitution, while the oxazol-5-yl group offers enhanced metabolic stability and hydrogen-bonding capacity. The compound exhibits bench stability, ease of purification, and compatibility with standard reaction conditions, making it ideal for medicinal chemistry campaigns and process-scale applications.

Synthesis

  • Route1

    References

    • PROSKELIA SAS Patent: WO2007/60026 A1, 2007 ; Location in patent: Page/Page column 53-54 ; WO 2007/060026 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H319
Precautionary Statements : P264-P270-P280-P330-P405-P501

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Computational Chemistry Data

  • TPSA   52.05
  • LogP   1.9238
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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