CAS 1001499-90-6

Methyl 1-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1H-pyrazole-3-carboxylate

Description:

Methyl 1-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1H-pyrazole-3-carboxylate is a chemical compound characterized by its pyrazole core, which is a five-membered ring containing two nitrogen atoms. This compound features a methyl ester functional group, contributing to its solubility in organic solvents. The presence of a chloro substituent and additional methyl groups on the pyrazole ring enhances its biological activity and may influence its reactivity and interaction with other molecules. The compound is likely to exhibit properties typical of pyrazole derivatives, such as potential herbicidal or fungicidal activity, making it of interest in agricultural chemistry. Its molecular structure suggests it may participate in various chemical reactions, including nucleophilic substitutions and esterifications. Additionally, the compound's stability, solubility, and reactivity can be influenced by environmental factors such as pH and temperature. Overall, this substance represents a class of compounds with diverse applications in pharmaceuticals and agrochemicals.

Formula: C₁₁H₁₃ClN₄O₂

InChI: InChI=1S/C11H13ClN4O2/c1-7-10(12)8(2)16(13-7)6-15-5-4-9(14-15)11(17)18-3/h4-5H,6H2,1-3H3

InChI key: InChIKey=TVOFRCQCJUVYHJ-UHFFFAOYSA-N

SMILES: C(N1C(C)=C(Cl)C(C)=N1)N2N=C(C(OC)=O)C=C2

Synonyms:

• 1H-Pyrazole-3-carboxylic acid, 1-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-, methyl ester
• Methyl 1-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-1H-pyrazole-3-carboxylate