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CS-W001157 4
Total: USD 88.00

5-Bromo-2-methoxybenzoic acid

  • CAS No. 2476-35-9

  • Cat. No. CS-W008181
  • Purity≥98%
  • MDL No.MFCD00093713

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

5-Bromo-2-methoxybenzoic acid|CS-W008181

Structure of 2476-35-9

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General Information

  • CAS No. 2476-35-9
  • Cat. No. CS-W008181
  • Purity ≥98%
  • MDL No. MFCD00093713
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇BrO₃
  • Molecular Weight 231.04
  • Synonym(s) benzoic acid, 5-bromo-2-methoxy-; 5-Bromo-2-methoxybenzoic acid
  • SMILES O=C(O)C1=CC(Br)=CC=C1OC

Description

5-Bromo-2-methoxybenzoic acid features a bromine substituent at the 5-position and a methoxy group at the 2-position, creating a sterically constrained, electron-rich aromatic core. This configuration enhances its utility in cross-coupling reactions and as a building block for bioactive heterocycles. The carboxylic acid moiety enables direct derivatization or salt formation for improved solubility and handling under standard conditions.

Application

5-Bromo-2-methoxybenzoic acid serves as a versatile building block in medicinal chemistry and materials science, enabling efficient diversification via Suzuki-Miyaura and Stille coupling reactions. Its bromo group provides a reliable handle for cross-coupling, while the methoxy and carboxylic acid functionalities offer orthogonal reactivity for derivatization. The compound exhibits excellent bench stability and facilitates straightforward purification, making it well-suited for scalable synthesis and downstream functionalization in API development.

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   2.1559
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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