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[1,1'-Biphenyl]-3-ylmethanamine

  • CAS No. 177976-49-7

  • Cat. No. CS-0156417
  • Purity≥98%
  • MDL No.MFCD00270124

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

[1,1'-Biphenyl]-3-ylmethanamine|CS-0156417

Structure of 177976-49-7

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General Information

  • CAS No. 177976-49-7
  • Cat. No. CS-0156417
  • Purity ≥98%
  • MDL No. MFCD00270124
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₃N
  • Molecular Weight 183.25
  • Synonym(s) Biphenyl-3-methanamine
  • SMILES C1=CC=C(C=C1)C2=CC=CC(=C2)CN

Description

This biphenyl-based amine features a rigid, electron-rich aryl scaffold that enhances π-stacking interactions in supramolecular systems. The primary amine group enables straightforward functionalization, while the para-substituted phenyl ring ensures high stability under standard conditions. Ideal for ligand design and bioactive molecule synthesis.

Application

[1,1'-Biphenyl]-3-ylmethanamine serves as a versatile building block in medicinal chemistry, enabling the construction of biaryl-containing scaffolds through standard coupling reactions. Its benzylic amine functionality offers robust reactivity in amide bond formation, reductive amination, and electrophilic substitution. The biphenyl core provides enhanced rigidity and π-stacking potential, while the primary amine is compatible with common protecting groups and purification methods. Bench-stable and readily handled, it facilitates efficient synthesis of complex heterocyclic and drug-like molecules.

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3259
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H314
Precautionary Statements : P260-P264-P270-P280-P301+P330+P331-P304+P340-P363-P405-P501

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   2.8123
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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