Cas no 24215-47-2 (alpha-(p-Chlorophenoxy)isobutyric acid, (2-hydroxyethylamino) ester)

alpha-(p-Chlorophenoxy)isobutyric acid, (2-hydroxyethylamino) ester structure
24215-47-2 structure
Product Name:alpha-(p-Chlorophenoxy)isobutyric acid, (2-hydroxyethylamino) ester
CAS No:24215-47-2
MF:C12H18ClNO4
MW:275.728622913361
CID:259981
PubChem ID:3032797
Update Time:2025-04-19

alpha-(p-Chlorophenoxy)isobutyric acid, (2-hydroxyethylamino) ester Chemical and Physical Properties

Names and Identifiers

    • alpha-(p-Chlorophenoxy)isobutyric acid, (2-hydroxyethylamino) ester
    • DTXSID30947030
    • Clofenat
    • 24215-47-2
    • 2-(4-Chlorophenoxy)-2-methylpropanoic acid--2-aminoethan-1-ol (1/1)
    • Inchi: 1S/C10H11ClO3.C2H7NO/c1-10(2,9(12)13)14-8-5-3-7(11)4-6-8;3-1-2-4/h3-6H,1-2H3,(H,12,13);4H,1-3H2
    • InChI Key: KLPBTTNQRGAAGZ-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=CC=1)OC(C(=O)O)(C)C.OCCN

Computed Properties

  • Exact Mass: 275.09254
  • Monoisotopic Mass: 275.0924357g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 217
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 92.8?2

Experimental Properties

  • PSA: 92.78
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