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CS-W001157 4
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Methyl 2-(4-fluorophenyl)-2-oxoacetate

  • CAS No. 156276-23-2

  • Cat. No. CS-0129107
  • Purity≥98%
  • MDL No.MFCD11617610

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

Methyl 2-(4-fluorophenyl)-2-oxoacetate|CS-0129107

Structure of 156276-23-2

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General Information

  • CAS No. 156276-23-2
  • Cat. No. CS-0129107
  • Purity ≥98%
  • MDL No. MFCD11617610
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇FO₃
  • Molecular Weight 182.15
  • Synonym(s) methyl (p-fluorobenzoyl)formate
  • SMILES O=C(OC)C(C1=CC=C(F)C=C1)=O

Description

Methyl 2-(4-fluorophenyl)-2-oxoacetate features a fluorinated aryl group that enhances electronic effects and metabolic stability. This ketone-containing ester integrates readily into synthetic sequences, serving as a key building block for pharmaceutical intermediates and functionalized heterocycles under standard conditions.

Application

Methyl 2-(4-fluorophenyl)-2-oxoacetate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to substituted β-keto esters and heterocyclic scaffolds. Its electrophilic α-carbon facilitates nucleophilic addition reactions, while the fluorophenyl group imparts favorable electronic and metabolic stability. The compound exhibits excellent bench stability, ease of purification, and compatibility with standard coupling and cyclization protocols, making it well-suited for medicinal chemistry and process development workflows.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   43.37
  • LogP   1.1814
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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