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CS-W001157 4
Total: USD 88.00

Phenylglyoxylic acid

  • CAS No. 611-73-4

  • Cat. No. CS-W010971
  • Purity≥98%
  • MDL No.MFCD00002575

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

Phenylglyoxylic acid|CS-W010971

Structure of 611-73-4

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General Information

  • CAS No. 611-73-4
  • Cat. No. CS-W010971
  • Purity ≥98%
  • MDL No. MFCD00002575
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆O₃
  • Molecular Weight None
  • Synonym(s) Benzoylformic acid
  • SMILES O=C(O)C(C1=CC=CC=C1)=O

Application

Phenylglyoxylic acid serves as a versatile synthon in organic synthesis, enabling the construction of α-hydroxy- and α-amino-carbonyl derivatives through standard transformations. Its carboxylic acid and carbonyl functionalities facilitate nucleophilic additions, condensations, and heterocycle formation, particularly in the synthesis of biologically relevant scaffolds. The compound exhibits good bench stability and is readily purified by recrystallization, supporting its use in iterative synthetic sequences and process-scale applications.

Synthesis

  • Route1
    • (R)-2-Hydroxy-2-phenylacetic acid  Pregabalin Impurity|CS-0167074
      611-71-2
    • ~96%
    • In-stock
      Phenylglyoxylic acid|CS-W010971
      611-73-4

    References

    • Al-Haq, Nazli; Sullivan, Alice C.; Wilson, John R. H. Tetrahedron Letters, 2003 , vol. 44, # 4 p. 769 - 771
  • Route2

    References

    • Al-Hunaiti, Afnan; Niemi, Teemu; Sibaouih, Ahlam; Pihko, Petri; Leskelae, Markku; Repo, Timo Chemical Communications, 2010 , vol. 46, # 48 p. 9250 - 9252
  • Route3

    References

    • Bulletin de la Societe Chimique de France, , vol. <3> 15, p. 1017

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313

Quality Control

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Computational Chemistry Data

  • TPSA   54.37
  • LogP   0.9539
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   2

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