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CS-W001157 4
Total: USD 88.00

2-Benzylaniline

  • CAS No. 28059-64-5

  • Cat. No. CS-W017039
  • Purity≥98%
  • MDL No.MFCD00007750

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

2-Benzylaniline|CS-W017039

Structure of 28059-64-5

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General Information

  • CAS No. 28059-64-5
  • Cat. No. CS-W017039
  • Purity ≥98%
  • MDL No. MFCD00007750
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₃N
  • Molecular Weight 183.25
  • Synonym(s) 2-Aminodiphenylmethane
  • SMILES NC=1C=CC=CC1CC=2C=CC=CC2

Description

2-Benzylaniline features a benzyl group directly attached to the aniline nitrogen, enhancing solubility and stability compared to unsubstituted anilines. This substitution pattern facilitates direct incorporation into pharmaceutical intermediates and functional materials, offering improved handling and reactivity in synthetic workflows.

Application

2-Benzylaniline serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling efficient access to biologically relevant heterocyclic scaffolds. Its benzylated aniline functionality exhibits favorable bench stability and compatibility with standard coupling reactions, facilitating functional group transformations under mild conditions. The molecule functions effectively in C–H activation, electrophilic substitution, and transition-metal-catalyzed cross-coupling processes, offering reliable reactivity for the construction of complex molecular architectures in multi-step syntheses.

Synthesis

  • Route1

    References

    • Konica Minolta Chemical Co., Ltd. Patent: EP1508564 A1, 2005 ; Location in patent: Page column 6 ;
  • Route2
    • null|null
      5840-40-4
    • ~%
    • In-stock
      2-Benzylaniline|CS-W017039
      28059-64-5

    References

    • Moore; Harrington; Swingle Journal of Medicinal Chemistry, 1975 , vol. 18, # 4 p. 386 - 391
  • Route3
    • 2-Aminobenzophenone Nepafenac Impurity|CS-0229200
      2835-77-0
    • ~92%
    • In-stock
      2-Benzylaniline|CS-W017039
      28059-64-5

    References

    • Yates, Peter; Schwartz, David Aaron Canadian Journal of Chemistry, 1983 , vol. 61, p. 509 - 518

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+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   2.8596
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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