Cas no 17969-41-4 ([2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]acetic acid)

[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]acetic acid structure
17969-41-4 structure
Product Name:[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]acetic acid
CAS No:17969-41-4
MF:C12H10ClNO2S
MW:267.731300830841
CID:1370464
PubChem ID:28859
Update Time:2025-04-20

[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]acetic acid Chemical and Physical Properties

Names and Identifiers

    • [2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]acetic acid
    • 2-(p-Chlorophenyl)-4-methyl-5-thiazoleacetic acid
    • 2-[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]acetic acid
    • 2-[2-(4-chlorophenyl)-4-methylthiazol-5-yl]acetic acid
    • 2-(4'-Chlorophenyl)-4-methylthiazole-5-acetic acid
    • AKOS013989954
    • 5-THIAZOLEACETIC ACID, 2-(p-CHLOROPHENYL)-4-METHYL-
    • Acide p-chlorophenyl-2 methyl-4-thiazole-acetique-5
    • BRN 1122113
    • SCHEMBL2069982
    • [2-(4-Chlorophenyl)-4-methyl-1,3-thiazol-5-yl]acetic acid #
    • DTXSID00170853
    • Acide p-chlorophenyl-2 methyl-4-thiazole-acetique-5 [French]
    • 17969-41-4
    • Inchi： 1S/C12H10ClNO2S/c1-7-10(6-11(15)16)17-12(14-7)8-2-4-9(13)5-3-8/h2-5H,6H2,1H3,(H,15,16)
    • InChI Key： PQLZUIFGDGNALU-UHFFFAOYSA-N
    • SMILES： ClC1C=CC(=CC=1)C1=NC(C)=C(CC(=O)O)S1

Computed Properties

  • Exact Mass: 267.0122
  • Monoisotopic Mass: 267.012
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 3
  • Complexity: 282
  • 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: 3.9
  • Topological Polar Surface Area: 78.4A^2

Experimental Properties

  • Density: 1.386
  • Boiling Point: 456.6°C at 760 mmHg
  • Flash Point: 230°C
  • Refractive Index: 1.623
  • PSA: 50.19

[2-(4-chlorophenyl)-4-methyl-1,3-thiazol-5-yl]acetic acid Related Literature

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