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CAS 180741-47-3

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4-Chloro-5-methyl-1H-pyrazole-1-propanoic acid

Description:
4-Chloro-5-methyl-1H-pyrazole-1-propanoic acid is a chemical compound characterized by its pyrazole ring structure, which is a five-membered ring containing two nitrogen atoms. This compound features a chloro substituent at the 4-position and a methyl group at the 5-position of the pyrazole ring, along with a propanoic acid functional group. Its molecular formula typically includes carbon, hydrogen, chlorine, and nitrogen atoms, reflecting its complex structure. The presence of the carboxylic acid group contributes to its acidic properties, making it soluble in polar solvents. This compound is of interest in various fields, including pharmaceuticals and agrochemicals, due to its potential biological activity. It may exhibit herbicidal or fungicidal properties, making it useful in agricultural applications. Additionally, the specific arrangement of substituents can influence its reactivity and interaction with biological targets. As with many chemical substances, safety data sheets should be consulted for handling and toxicity information.
Formula:C7H9ClN2O2
InChI:InChI=1S/C7H9ClN2O2/c1-5-6(8)4-9-10(5)3-2-7(11)12/h4H,2-3H2,1H3,(H,11,12)
InChI key:InChIKey=VCKABMDGGVYSJS-UHFFFAOYSA-N
SMILES:C(CC(O)=O)N1C(C)=C(Cl)C=N1
Synonyms:
  • 1H-Pyrazole-1-propanoic acid, 4-chloro-5-methyl-
  • 4-Chloro-5-methyl-1H-pyrazole-1-propanoic acid
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