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CAS 56108-09-9

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Benzenecarboximidic acid, 3-(trifluoromethyl)-, methyl ester, hydrochloride (1:1)

Description:
Benzenecarboximidic acid, 3-(trifluoromethyl)-, methyl ester, hydrochloride (1:1), with the CAS number 56108-09-9, is a chemical compound characterized by its functional groups and structural features. It contains a benzenecarboximidic acid moiety, which is an aromatic compound featuring an imine functional group (-C=N-) adjacent to a carboxylic acid derivative. The presence of a trifluoromethyl group (-CF3) at the meta position of the benzene ring significantly influences its electronic properties, enhancing its lipophilicity and potentially affecting its reactivity and biological activity. The methyl ester group contributes to its solubility and stability, while the hydrochloride form indicates that it is a salt, which can enhance its solubility in polar solvents. This compound may exhibit various applications in medicinal chemistry and agrochemicals due to its unique structural characteristics. As with many chemical substances, safety data and handling precautions should be observed, as it may possess toxicological properties.
Formula:C9H8F3NO·ClH
InChI:InChI=1S/C9H8F3NO.ClH/c1-14-8(13)6-3-2-4-7(5-6)9(10,11)12;/h2-5,13H,1H3;1H
InChI key:InChIKey=KLCFCQSOUZFEOY-UHFFFAOYSA-N
SMILES:C(OC)(=N)C1=CC(C(F)(F)F)=CC=C1.Cl
Synonyms:
  • Benzenecarboximidic acid, 3-(trifluoromethyl)-, methyl ester, hydrochloride (1:1)
  • Benzenecarboximidic acid, 3-(trifluoromethyl)-, methyl ester, hydrochloride
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