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CS-W001157 4
Total: USD 88.00

1-Bromo-4-octylbenzene

  • CAS No. 51554-93-9

  • Cat. No. CS-W012401
  • Purity≥97%
  • MDL No.MFCD00038348

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

1-Bromo-4-octylbenzene|CS-W012401

Structure of 51554-93-9

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General Information

  • CAS No. 51554-93-9
  • Cat. No. CS-W012401
  • Purity ≥97%
  • MDL No. MFCD00038348
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₂₁Br
  • Molecular Weight None
  • Synonym(s) 4-n-Octylbromobenzene
  • SMILES CCCCCCCCC1=CC=C(Br)C=C1

Description

1-Bromo-4-octylbenzene is a halogenated aromatic compound featuring a linear alkyl chain that enhances solubility in organic media. This structure enables straightforward incorporation into cross-coupling reactions, serving as a robust building block for functionalized aryl systems in materials science and synthetic chemistry workflows.

Application

1-Bromo-4-octylbenzene serves as a versatile aryl halide building block for palladium-catalyzed cross-coupling reactions, including Suzuki, Stille, and Negishi couplings. Its linear alkyl chain enhances solubility in organic media while maintaining bench stability. The bromine substituent enables reliable functionalization under standard conditions, facilitating the synthesis of complex biaryl architectures relevant to pharmaceutical and materials chemistry.

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

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Computational Chemistry Data

  • TPSA   0
  • LogP   5.3521
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   7

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