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CS-W001157 4
Total: USD 88.00

2-(4-Ethylphenyl)-2-oxoacetic acid

  • CAS No. 7099-89-0

  • Cat. No. CS-0296613
  • Purity≥98%
  • MDL No.None

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

2-(4-Ethylphenyl)-2-oxoacetic acid|CS-0296613

Structure of 7099-89-0

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General Information

  • CAS No. 7099-89-0
  • Cat. No. CS-0296613
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₀O₃
  • Molecular Weight 178.18
  • Synonym(s) α-Oxo-4-aethyl-phenylessigsaeure
  • SMILES CCC1=CC=C(C=C1)C(=O)C(=O)O

Description

2-(4-Ethylphenyl)-2-oxoacetic acid features a conjugated ketone moiety flanked by an ethyl-substituted phenyl ring, delivering enhanced stability and solubility in organic solvents. This structure enables efficient integration into synthetic routes for pharmaceutical intermediates and functional materials.

Application

2-(4-Ethylphenyl)-2-oxoacetic acid serves as a versatile building block for synthesizing substituted benzophenones and heterocyclic systems via standard condensation and cyclization protocols. Its α-keto carboxylic acid functionality enables efficient transformations including decarboxylation, esterification, and nucleophilic addition, with good bench stability and straightforward purification by recrystallization or column chromatography.

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P330-P362-P501

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Computational Chemistry Data

  • TPSA   54.37
  • LogP   1.5163
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   3

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