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CAS 1421761-18-3

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Benzoic acid, 3-chloro-4-fluoro-, sodium salt (1:1)

Description:
Benzoic acid, 3-chloro-4-fluoro-, sodium salt (1:1) is a chemical compound characterized by its structure, which includes a benzoic acid moiety substituted with both a chlorine atom at the 3-position and a fluorine atom at the 4-position of the aromatic ring. As a sodium salt, it typically exists as a white to off-white solid that is soluble in water, reflecting the ionic nature of the sodium component. This compound may exhibit properties typical of both benzoic acids and halogenated aromatic compounds, such as potential antimicrobial activity and applications in various chemical syntheses. Its molecular interactions can be influenced by the presence of the halogen substituents, which can affect its reactivity and stability. Additionally, the compound may be used in research and industrial applications, particularly in the fields of pharmaceuticals and agrochemicals. Safety data should be consulted for handling and exposure guidelines, as halogenated compounds can pose specific health and environmental risks.
Formula:C7H4ClFO2·Na
InChI:InChI=1S/C7H4ClFO2.Na/c8-5-3-4(7(10)11)1-2-6(5)9;/h1-3H,(H,10,11);
InChI key:InChIKey=DQRGUPAOQOGLQY-UHFFFAOYSA-N
SMILES:C(O)(=O)C1=CC(Cl)=C(F)C=C1.[Na]
Synonyms:
  • Benzoic acid, 3-chloro-4-fluoro-, sodium salt (1:1)
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