Cas no 1185293-73-5 (1,3-dimethyl-1H-pyrazole-4-carboxylic acid hydrochloride)

1,3-Dimethyl-1H-pyrazole-4-carboxylic acid hydrochloride is a heterocyclic carboxylic acid derivative with a molecular formula of C?H?N?O?·HCl. This compound serves as a versatile building block in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals. Its pyrazole core offers structural rigidity, while the carboxylic acid functionality allows for further derivatization via amidation, esterification, or other coupling reactions. The hydrochloride salt form enhances solubility and stability, facilitating handling and storage. The compound is valued for its high purity and consistent performance in medicinal chemistry applications, including the synthesis of biologically active molecules. Its well-defined structure makes it a reliable intermediate for research and industrial processes.
1,3-dimethyl-1H-pyrazole-4-carboxylic acid hydrochloride structure
1185293-73-5 structure
Product Name:1,3-dimethyl-1H-pyrazole-4-carboxylic acid hydrochloride
CAS No:1185293-73-5
MF:C6H9ClN2O2
MW:176.600860357285
CID:3046034
PubChem ID:45074835
Update Time:2025-05-27

1,3-dimethyl-1H-pyrazole-4-carboxylic acid hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 1H-?Pyrazole-?4-?carboxylic acid, 1,?3-?dimethyl-?, hydrochloride (1:1)
    • 1,3-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLIC ACIDHYDROCHLORIDE
    • 1,3-dimethyl-1H-pyrazole-4-carboxylic acid hydrochloride
    • 1,3-dimethylpyrazole-4-carboxylic acid hydrochloride
    • CS-0183613
    • 1,3-dimethylpyrazole-4-carboxylic acid;hydrochloride
    • SCHEMBL10666393
    • 1,3-DIMETHYL-1H-PYRAZOLE-4-CARBOXYLICACIDHYDROCHLORIDE
    • 1185293-73-5
    • AKOS015845876
    • Inchi： 1S/C6H8N2O2.ClH/c1-4-5(6(9)10)3-8(2)7-4;/h3H,1-2H3,(H,9,10);1H
    • InChI Key： PCSQHYMWILFNMX-UHFFFAOYSA-N
    • SMILES： N1(C)C=C(C(O)=O)C(C)=N1.[H]Cl

Computed Properties

  • Exact Mass: 176.0352552g/mol
  • Monoisotopic Mass: 176.0352552g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 149
  • 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: 55.1?2

Experimental Properties

  • Melting Point: NA

1,3-dimethyl-1H-pyrazole-4-carboxylic acid hydrochloride Security Information

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