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CAS 1305320-57-3

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1H-Pyrazole-4-carboxylic acid, 3,5-dimethyl-, ethyl ester, hydrochloride (1:1)

Description:
1H-Pyrazole-4-carboxylic acid, 3,5-dimethyl-, ethyl ester, hydrochloride (1:1) is a chemical compound characterized by its pyrazole ring structure, which is a five-membered aromatic ring containing two nitrogen atoms. This compound features a carboxylic acid functional group and an ethyl ester moiety, contributing to its potential reactivity and solubility properties. The presence of the 3,5-dimethyl substituents on the pyrazole ring enhances its lipophilicity and may influence its biological activity. As a hydrochloride salt, it is typically more soluble in water compared to its free base form, which is advantageous for various applications, including pharmaceuticals. The compound may exhibit interesting pharmacological properties, making it a subject of interest in medicinal chemistry. Its CAS number, 1305320-57-3, allows for precise identification in chemical databases. Overall, this compound's unique structural features and functional groups suggest potential utility in research and development within the fields of organic synthesis and drug discovery.
Formula:C8H12N2O2·ClH
InChI:InChI=1S/C8H12N2O2.ClH/c1-4-12-8(11)7-5(2)9-10-6(7)3;/h4H2,1-3H3,(H,9,10);1H
InChI key:InChIKey=QZGZCHFHAGNIRG-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C=1C(C)=NNC1C.Cl
Synonyms:
  • 1H-Pyrazole-4-carboxylic acid, 3,5-dimethyl-, ethyl ester, hydrochloride (1:1)
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