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CS-W001157 4
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(2-bromo-3-methylphenyl)methanol

  • CAS No. 168886-97-3

  • Cat. No. CS-W000130
  • Purity≥97%
  • MDL No.MFCD16659614

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

(2-bromo-3-methylphenyl)methanol|CS-W000130

Structure of 168886-97-3

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General Information

  • CAS No. 168886-97-3
  • Cat. No. CS-W000130
  • Purity ≥97%
  • MDL No. MFCD16659614
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉BrO
  • Molecular Weight 201.06
  • Synonym(s) 2-bromo-3-methylbenzyl alcohol
  • SMILES Cc1cccc(CO)c1Br

Description

This bench-stable benzyl alcohol derivative features a bromine atom at the ortho position and a methyl group at the meta site, enabling selective functionalization in cross-coupling reactions. The para-position remains available for further derivatization, supporting modular synthesis in medicinal chemistry and materials science applications.

Application

(2-Bromo-3-methylphenyl)methanol serves as a versatile building block for C–C and C–heteroatom coupling reactions, enabling efficient access to substituted biaryl and heterocyclic scaffolds. Its brominated aryl moiety supports palladium-catalyzed cross-coupling, while the benzylic alcohol functionality offers straightforward derivatization via oxidation or protection. The compound exhibits good bench stability and is compatible with common functional groups, facilitating integration into multi-step synthesis workflows.

Synthesis

  • Route1

    References

    • AMGEN INC.; PARAS, Nick A,; BROWN, James; CHENG, Yuan; HITCHCOCK, Stephen; JUDD, Ted; LOPEZ, Patricia; MINATTI, Ana Elena; NIXEY, Thomas; POWERS, Timothy; TEGLEY, Christopher M.; XUE, Qiufen; YANG, Bryant; ZHONG, Wenge Patent: WO2011/90911 A1, 2011 ; Location in patent: Page/Page column 54; 55 ; WO 2011/090911 A1

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   20.23
  • LogP   2.24982
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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