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CAS 258273-31-3

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3-Cyano-4-(1-methylethoxy)benzoic acid

Description:
3-Cyano-4-(1-methylethoxy)benzoic acid is an organic compound characterized by its aromatic structure, which includes a benzoic acid moiety substituted with a cyano group and an ethoxy group. The presence of the cyano group (-CN) introduces a polar functional group that can participate in various chemical reactions, such as nucleophilic additions. The 1-methylethoxy group, which is an ether, contributes to the compound's hydrophobic characteristics, influencing its solubility and reactivity. This compound is typically used in organic synthesis and may serve as an intermediate in the production of pharmaceuticals or agrochemicals. Its molecular structure suggests potential applications in materials science, particularly in the development of dyes or polymers. Additionally, the presence of both polar and non-polar functional groups allows for interesting interactions in biological systems, making it a candidate for further research in medicinal chemistry. Safety data should be consulted for handling and storage, as with any chemical substance.
Formula:C11H11NO3
InChI:InChI=1S/C11H11NO3/c1-7(2)15-10-4-3-8(11(13)14)5-9(10)6-12/h3-5,7H,1-2H3,(H,13,14)
InChI key:InChIKey=FQGLEMDXDTZJMJ-UHFFFAOYSA-N
SMILES:O(C(C)C)C1=C(C#N)C=C(C(O)=O)C=C1
Synonyms:
  • 3-Cyano-4-(1-methylethoxy)benzoic acid
  • 3-Cyano-4-(Propan-2-Yloxy)Benzoic Acid
  • 3-Cyano-4-[(1-methylethyl)oxy]benzoic acid
  • 3-Cyano-4-isopropoxy-benzoic acid
  • 3-Cyano-4-isopropyloxybenzoic acid
  • Benzoic Acid, 3-Cyano-4-(1-Methylethoxy)-
  • 3-Cyano-4-isopropoxybenzoic acid
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