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CS-W001157 4
Total: USD 88.00

2-[2-(METHOXYCARBONYL)PHENYL]ACETIC ACID

  • CAS No. 14736-49-3

  • Cat. No. CS-0037050
  • Purity≥98%
  • MDL No.None

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

2-[2-(METHOXYCARBONYL)PHENYL]ACETIC ACID|CS-0037050

Structure of 14736-49-3

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General Information

  • CAS No. 14736-49-3
  • Cat. No. CS-0037050
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀O₄
  • Molecular Weight 194.18
  • Synonym(s) 2-[2-(Methoxycarbonyl)phenyl]acetic acid
  • SMILES COC(=O)C1=CC=CC=C1CC(=O)O

Description

This acetic acid derivative features a methoxycarbonyl-substituted phenyl ring, offering enhanced solubility and stability in synthetic transformations. The ortho-positioned ester group enables selective derivatization while maintaining structural integrity under standard bench conditions. Ideal for coupling reactions in medicinal chemistry and polymer synthesis.

Application

2-(2-(Methoxycarbonyl)phenyl)acetic acid serves as a versatile building block for synthesizing biaryl and heterocyclic scaffolds common in medicinal chemistry. Its ortho-carboxylate functionality enables direct coupling reactions, while the pendant carboxylic acid facilitates derivatization via esterification, amidation, or cyclization. The molecule exhibits good bench stability and is readily purified by recrystallization or silica gel chromatography, making it well-suited for reproducible scale-up in API intermediate synthesis.

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   63.6
  • LogP   1.1003
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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