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CS-W001157 4
Total: USD 88.00

3-Bromo-4-fluorophenylacetic acid

  • CAS No. 194019-11-9

  • Cat. No. CS-W007630
  • Purity≥98%
  • MDL No.MFCD04038373

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

3-Bromo-4-fluorophenylacetic acid|CS-W007630

Structure of 194019-11-9

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General Information

  • CAS No. 194019-11-9
  • Cat. No. CS-W007630
  • Purity ≥98%
  • MDL No. MFCD04038373
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆BrFO₂
  • Molecular Weight 233.03
  • Synonym(s) 3-Bromo-4-fluorobenzeneacetic acid
  • SMILES BrC1=C(C=CC(=C1)CC(=O)O)F

Description

3-Bromo-4-fluorophenylacetic acid features a bromo and fluoro substituent positioned ortho to the acetic acid side chain, delivering enhanced electron-withdrawing character and improved metabolic stability. This structural motif facilitates direct incorporation into bioactive scaffolds, enabling efficient C–C bond formation in cross-coupling reactions under standard conditions.

Application

3-Bromo-4-fluorophenylacetic acid serves as a versatile building block for the synthesis of pharmaceutically relevant heterocycles and bioactive molecules. Its orthogonal halogenation pattern enables selective cross-coupling reactions, while the carboxylic acid functionality facilitates direct derivatization or incorporation into peptide-like scaffolds. The compound exhibits excellent bench stability and compatibility with standard purification techniques, making it well-suited for iterative synthetic workflows in medicinal chemistry and process development.

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   37.3
  • LogP   2.2153
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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