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CS-W001157 4
Total: USD 88.00

4-Bromobenzylamine

  • CAS No. 3959-07-7

  • Cat. No. CS-W007375
  • Molecule weight186.05
  • Purity≥95%
  • MDL No.MFCD00047931

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

4-Bromobenzylamine|CS-W007375

Structure of 3959-07-7

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General Information

  • CAS No. 3959-07-7
  • Cat. No. CS-W007375
  • Purity ≥95%
  • MDL No. MFCD00047931
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈BrN
  • Molecular Weight 186.05
  • Synonym(s) None
  • SMILES NCC1=CC=C(Br)C=C1

Description

4-Bromobenzylamine features a brominated aromatic ring linked to a primary amine group, enabling direct functionalization in cross-coupling and amine substitution reactions. This bench-stable compound integrates readily into pharmaceutical intermediates and bioactive molecule scaffolds where halogen-directed derivatization is required.

Application

4-Bromobenzylamine serves as a versatile building block in medicinal chemistry and synthetic organic chemistry, enabling the construction of diverse heterocyclic scaffolds and bioactive molecules. Its bromo substituent facilitates palladium-catalyzed cross-coupling reactions, while the primary amine group offers straightforward derivatization via acylation, alkylation, or reductive amination. The compound exhibits good bench stability and is readily purified by distillation or crystallization, supporting its use in multi-step synthesis and process development workflows.

Synthesis

  • Route1

    References

    • Helvetica Chimica Acta, , vol. 71, p. 1999 - 2021
  • Route2
    • null|null
      107047-10-9
    • ~61%
    • In-stock
      4-Bromobenzylamine|CS-W007375
      3959-07-7

    References

    • WO2008/13963 A2, ; Page/Page column 70 ; WO 2008/013963 A2
  • Route3
    • 2-(4-Bromobenzyl)isoindoline-1,3-dione|CS-0186411
      153171-22-3
    • ~92%
    • In-stock
      4-Bromobenzylamine|CS-W007375
      3959-07-7

    References

    • Chemistry - A European Journal, , vol. 16, # 33 p. 10171 - 10177

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 1760
Class : 8
Packing Group : Ⅱ
Hazard Statements : H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P304+P340-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   1.9078
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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