Cas no 61560-94-9 (2-(3-methylphenyl)-2-oxoacetic acid)

2-(3-Methylphenyl)-2-oxoacetic acid is an aromatic α-keto acid derivative characterized by its ketone and carboxylic acid functional groups. This compound is of interest in organic synthesis due to its reactivity as a building block for pharmaceuticals, agrochemicals, and fine chemicals. The presence of the methyl substituent on the phenyl ring enhances its stability while allowing further functionalization. Its α-keto acid moiety makes it a versatile intermediate for condensation, reduction, and nucleophilic addition reactions. The compound is typically used in research and development settings, where its purity and structural specificity are critical for precise synthetic applications. Proper handling and storage are recommended to maintain its integrity.
2-(3-methylphenyl)-2-oxoacetic acid structure
61560-94-9 structure
Product Name:2-(3-methylphenyl)-2-oxoacetic acid
CAS No:61560-94-9
MF:C9H8O3
MW:164.158022880554
CID:2105439
PubChem ID:12338407
Update Time:2025-06-08

2-(3-methylphenyl)-2-oxoacetic acid Chemical and Physical Properties

Names and Identifiers

    • 2-oxo-2-m-tolylacetic acid
    • 2-(3-methylphenyl)-2-oxoacetic acid
    • 61560-94-9
    • Z1255379743
    • CS-0234620
    • DB-330518
    • AKOS022636708
    • SCHEMBL2060236
    • EN300-144643
    • (3-Methylphenyl)glyoxylic acid
    • 2-Oxo-2-(m-tolyl)aceticacid
    • 2-Oxo-2-(m-tolyl)acetic acid
    • 893-239-2
    • G31930
    • LCA56094
    • MDL: MFCD07698692
    • Inchi: 1S/C9H8O3/c1-6-3-2-4-7(5-6)8(10)9(11)12/h2-5H,1H3,(H,11,12)
    • InChI Key: GZXVAVNQNKCFFN-UHFFFAOYSA-N
    • SMILES: O=C(C(=O)O)C1=CC=CC(C)=C1

Computed Properties

  • Exact Mass: 164.047344113g/mol
  • Monoisotopic Mass: 164.047344113g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 198
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.3
  • Topological Polar Surface Area: 54.4?2

2-(3-methylphenyl)-2-oxoacetic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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