Cas no 639523-17-4 (3-cyclopropyl-1,2-oxazole-4-carboxylic acid)

3-cyclopropyl-1,2-oxazole-4-carboxylic acid structure
639523-17-4 structure
Product Name:3-cyclopropyl-1,2-oxazole-4-carboxylic acid
CAS No:639523-17-4
MF:C7H7NO3
MW:153.135381937027
CID:500388
PubChem ID:45084772
Update Time:2025-04-19

3-cyclopropyl-1,2-oxazole-4-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 4-Isoxazolecarboxylicacid, 3-cyclopropyl-
    • 3-Cyclopropylisoxazole-4-carboxylicacid
    • 3-cyclopropyl-1,2-oxazole-4-carboxylic acid
    • 4-Isoxazolecarboxylicacid,3-cyclopropyl-(9CI)
    • EN300-181047
    • F8888-4112
    • AKOS022716818
    • DTXSID20665695
    • Z1216841456
    • 3-cyclopropylisoxazole-4-carboxylic acid
    • 639523-17-4
    • 3-cyclopropyl-isoxazole-4-carboxylic acid
    • NJEPDWZYBJIKMD-UHFFFAOYSA-N
    • SCHEMBL932926
    • AT22061
    • DB-283770
    • 4-Isoxazolecarboxylic acid, 3-cyclopropyl-
    • Inchi: 1S/C7H7NO3/c9-7(10)5-3-11-8-6(5)4-1-2-4/h3-4H,1-2H2,(H,9,10)
    • InChI Key: NJEPDWZYBJIKMD-UHFFFAOYSA-N
    • SMILES: O1C=C(C(=O)O)C(C2CC2)=N1

Computed Properties

  • Exact Mass: 153.04261
  • Monoisotopic Mass: 153.042593085g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 179
  • 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: 0.5
  • Topological Polar Surface Area: 63.3?2

Experimental Properties

  • PSA: 63.33

3-cyclopropyl-1,2-oxazole-4-carboxylic acid Security Information

3-cyclopropyl-1,2-oxazole-4-carboxylic acid Pricemore >>

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