Cas no 397867-89-9 (4-THIAZOLECARBOXYLIC ACID, HYDROCHLORIDE)

4-THIAZOLECARBOXYLIC ACID, HYDROCHLORIDE structure
397867-89-9 structure
Product Name:4-THIAZOLECARBOXYLIC ACID, HYDROCHLORIDE
CAS No:397867-89-9
MF:C4H4ClNO2S
MW:165.598058700562
CID:3312919
PubChem ID:45158343
Update Time:2025-04-21

4-THIAZOLECARBOXYLIC ACID, HYDROCHLORIDE Chemical and Physical Properties

Names and Identifiers

    • 4-THIAZOLECARBOXYLIC ACID, HYDROCHLORIDE
    • 4-Thiazolecarboxylic acid, hydrochloride (1:1)
    • CS-0184776
    • 1,3-thiazole-4-carboxylic acid hydrochloride
    • CHEMBL4126899
    • 397867-89-9
    • Thiazole-4-carboxylicacidhydrochloride
    • 1,3-thiazole-4-carboxylic acid;hydrochloride
    • MFCD12914027
    • SCHEMBL5744190
    • AKOS015948014
    • Thiazole-4-carboxylic acid hydrochloride
    • Inchi: 1S/C4H3NO2S.ClH/c6-4(7)3-1-8-2-5-3;/h1-2H,(H,6,7);1H
    • InChI Key: ZTWPYXYQAHBWLE-UHFFFAOYSA-N
    • SMILES: C(C1N=CSC=1)(=O)O.Cl

Computed Properties

  • Exact Mass: 164.9651272Da
  • Monoisotopic Mass: 164.9651272Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 106
  • 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
  • Topological Polar Surface Area: 78.4?2
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