Cas no 92724-22-6 (2-Oxazolecarboxylic acid, 4-methyl-5-phenyl-, ethyl ester)

2-Oxazolecarboxylic acid, 4-methyl-5-phenyl-, ethyl ester structure
92724-22-6 structure
Product Name:2-Oxazolecarboxylic acid, 4-methyl-5-phenyl-, ethyl ester
CAS No:92724-22-6
MF:C13H13NO3
MW:231.247223615646
CID:753047
PubChem ID:71329321
Update Time:2025-04-19

2-Oxazolecarboxylic acid, 4-methyl-5-phenyl-, ethyl ester Chemical and Physical Properties

Names and Identifiers

    • 2-Oxazolecarboxylic acid, 4-methyl-5-phenyl-, ethyl ester
    • ethyl 4-methyl-5-phenyl-1,3-oxazole-2-carboxylate
    • DTXSID80758158
    • 92724-22-6
    • Inchi: 1S/C13H13NO3/c1-3-16-13(15)12-14-9(2)11(17-12)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3
    • InChI Key: AFQCGIZZITYWEP-UHFFFAOYSA-N
    • SMILES: O1C(C(=O)OCC)=NC(C)=C1C1C=CC=CC=1

Computed Properties

  • Exact Mass: 231.08954328g/mol
  • Monoisotopic Mass: 231.08954328g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 263
  • 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: 3
  • Topological Polar Surface Area: 52.3?2
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