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CS-W001157 4
Total: USD 88.00

2,6-Dibromo-4-(tert-butyl)aniline

  • CAS No. 10546-67-5

  • Cat. No. CS-0036975
  • Purity≥98%
  • MDL No.MFCD06657952

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

2,6-Dibromo-4-(tert-butyl)aniline|CS-0036975

Structure of 10546-67-5

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General Information

  • CAS No. 10546-67-5
  • Cat. No. CS-0036975
  • Purity ≥98%
  • MDL No. MFCD06657952
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₃Br₂N
  • Molecular Weight 307.02
  • Synonym(s) 2,6-Dibromo-4-tert-butylaniline
  • SMILES NC1=C(Br)C=C(C(C)(C)C)C=C1Br

Description

Hydroquinone bis(2-hydroxyethyl) ether is used to produce 1,4-bis-(2-bromo-ethoxy)-benzene.

Application

2,6-Dibromo-4-(tert-butyl)aniline serves as a versatile building block for brominated aromatic scaffolds in medicinal chemistry and materials science. The tert-butyl group provides steric shielding and enhanced stability, while the ortho-bromine substituents enable palladium-catalyzed cross-coupling reactions with high regioselectivity. Its bench-stable nature and compatibility with standard purification protocols facilitate efficient synthesis of complex heterocycles and functionalized aryl targets.

Synthesis

  • Route1

    References

    • Miura; Oka; Momoki Synthesis, 1995 , # 11 p. 1419 - 1422
  • Route2

    References

    • Podgorsek, Ajda; Stavber, Stojan; Zupan, Marko; Iskra, Jernej Tetrahedron, 2009 , vol. 65, # 22 p. 4429 - 4439
  • Route3

    References

    • Drake et al. Journal of the American Chemical Society, 1946 , vol. 68, p. 1602,1603

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   4.0913
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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