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CAS 749920-21-6

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3-Chloro-5-methoxy-4-(3-methylbutoxy)benzoic acid

Description:
3-Chloro-5-methoxy-4-(3-methylbutoxy)benzoic acid is an organic compound characterized by its aromatic structure, which includes a benzoic acid moiety substituted with a chlorine atom, a methoxy group, and a 3-methylbutoxy side chain. The presence of the chlorine atom introduces electronegative characteristics, influencing the compound's reactivity and solubility. The methoxy group contributes to the compound's hydrophobic nature, while the 3-methylbutoxy group enhances its lipophilicity, potentially affecting its biological activity and interactions with other molecules. This compound may exhibit properties typical of benzoic acids, such as acidity and the ability to form salts or esters. Its unique structure suggests potential applications in pharmaceuticals or agrochemicals, where modifications to aromatic compounds can lead to enhanced efficacy or specificity. As with many organic compounds, its stability, solubility, and reactivity can be influenced by environmental factors such as pH and temperature. Safety data and handling precautions should be considered when working with this substance, as with any chemical compound.
Formula:C13H17ClO4
InChI:InChI=1S/C13H17ClO4/c1-8(2)4-5-18-12-10(14)6-9(13(15)16)7-11(12)17-3/h6-8H,4-5H2,1-3H3,(H,15,16)
InChI key:InChIKey=ZCRSVQBSDNJUGS-UHFFFAOYSA-N
SMILES:O(CCC(C)C)C1=C(OC)C=C(C(O)=O)C=C1Cl
Synonyms:
  • 3-Chloro-5-methoxy-4-(3-methylbutoxy)benzoic acid
  • Benzoic acid, 3-chloro-5-methoxy-4-(3-methylbutoxy)-
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