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CS-W001157 4
Total: USD 88.00

alpha-(4-Bromophenyl)benzylamine

  • CAS No. 55095-17-5

  • Cat. No. CS-0156537
  • Purity≥95%
  • MDL No.MFCD06616841

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

alpha-(4-Bromophenyl)benzylamine|CS-0156537

Structure of 55095-17-5

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General Information

  • CAS No. 55095-17-5
  • Cat. No. CS-0156537
  • Purity ≥95%
  • MDL No. MFCD06616841
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₂BrN
  • Molecular Weight 262.15
  • Synonym(s) (4-Bromophenyl)(phenyl)methanamine
  • SMILES C1=CC=C(C=C1)C(C2=CC=C(C=C2)Br)N

Description

alpha-(4-Bromophenyl)benzylamine features a brominated aryl group linked to a benzylamine scaffold, delivering enhanced electron-withdrawing character and improved metabolic stability. This configuration supports efficient incorporation into bioactive scaffolds and facilitates downstream functionalization in medicinal chemistry campaigns.

Application

alpha-(4-Bromophenyl)benzylamine serves as a versatile building block in medicinal chemistry, enabling the synthesis of biaryl-containing scaffolds via standard coupling reactions. Its brominated aryl group facilitates palladium-catalyzed cross-coupling transformations, while the primary amine functions as a handle for derivatization or incorporation into heterocyclic frameworks. The compound exhibits good bench stability and is compatible with common purification methods, making it suitable for scalable synthesis and process development.

Synthesis

  • Route1
    • null|null
      127568-31-4
    • ~76%
    • In-stock
      alpha-(4-Bromophenyl)benzylamine|CS-0156537
      55095-17-5

    References

    • MERCK SHARP and DOHME CORP.; ZHOU, Changyou; ZOU, Wuxin; HUA, Yuxia; DANG, Qun Patent: WO2013/40790 A1, 2013 ; Location in patent: Page/Page column 37 ;
  • Route2
    • null|null
      1445534-56-4
    • ~78%
    • In-stock
      alpha-(4-Bromophenyl)benzylamine|CS-0156537
      55095-17-5

    References

    • MERCK SHARP and DOHME CORP.; DANG, Qun; ZHOU, Changyou; ZOU, Wuxin; HUA, Yuxia Patent: WO2013/43624 A1, 2013 ; Location in patent: Page/Page column 37; 38 ;
  • Route3

    References

    • US6921763 B2, ;

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

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   3.4972
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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