Cas no 137267-49-3 (4-Oxazolecarboxylic acid, 2-ethyl-5-methyl-, ethyl ester)

4-Oxazolecarboxylic acid, 2-ethyl-5-methyl-, ethyl ester structure
137267-49-3 structure
Product Name:4-Oxazolecarboxylic acid, 2-ethyl-5-methyl-, ethyl ester
CAS No:137267-49-3
MF:C9H13NO3
MW:183.204422712326
CID:1251506
PubChem ID:11063064
Update Time:2025-04-20

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

Names and Identifiers

    • 4-Oxazolecarboxylic acid, 2-ethyl-5-methyl-, ethyl ester
    • ethyl 2-ethyl-5-methyl-1,3-oxazole-4-carboxylate
    • ETHYL 2-ETHYL-5-METHYLOXAZOLE-4-CARBOXYLATE
    • AKOS006309837
    • 2-ethyl-5-methyl-oxazole-4-carboxylic acid ethyl ester
    • ethyl 5-methyl-oxazole-4-carboxylic acid ethyl ester
    • AB63606
    • SB36629
    • 137267-49-3
    • DTXSID20453796
    • Inchi: 1S/C9H13NO3/c1-4-7-10-8(6(3)13-7)9(11)12-5-2/h4-5H2,1-3H3
    • InChI Key: QYSNAPIRTNZXTF-UHFFFAOYSA-N
    • SMILES: O1C(C)=C(C(=O)OCC)N=C1CC

Computed Properties

  • Exact Mass: 183.08959
  • Monoisotopic Mass: 183.08954328g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 184
  • 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: 2.1
  • Topological Polar Surface Area: 52.3?2

Experimental Properties

  • PSA: 52.33
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