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CS-W001157 4
Total: USD 88.00

4-Bromo-2,3-dimethylphenol

  • CAS No. 22802-37-5

  • Cat. No. CS-0153607
  • Purity≥98%
  • MDL No.MFCD07778969

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

4-Bromo-2,3-dimethylphenol|CS-0153607

Structure of 22802-37-5

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General Information

  • CAS No. 22802-37-5
  • Cat. No. CS-0153607
  • Purity ≥98%
  • MDL No. MFCD07778969
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉BrO
  • Molecular Weight 201.06
  • Synonym(s) None
  • SMILES CC1=C(C)C(=CC=C1Br)O

Description

4-Bromo-2,3-dimethylphenol features a bromine substituent at the para position relative to the phenolic hydroxyl, combined with methyl groups at adjacent ortho positions. This electron-rich scaffold enables direct coupling in cross-coupling reactions and offers enhanced solubility in organic media. The molecule exhibits bench-stable handling characteristics and serves as a key building block for functionalized aromatic systems in medicinal chemistry and materials synthesis.

Application

4-Bromo-2,3-dimethylphenol serves as a valuable building block in medicinal chemistry and agrochemical synthesis, enabling direct functionalization at the phenolic position. Its bromine substituent facilitates Suzuki-Miyaura and Stille couplings, while the methyl groups provide steric protection and enhance metabolic stability. The compound exhibits excellent bench stability and is compatible with standard purification techniques, making it ideal for iterative synthetic sequences and scaffold diversification.

Safety Information

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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   20.23
  • LogP   2.77154
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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