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CAS 69226-41-1

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Benzoic acid, 3-(trifluoromethyl)-, sodium salt (1:1)

Description:
Benzoic acid, 3-(trifluoromethyl)-, sodium salt (1:1), with the CAS number 69226-41-1, is a sodium salt derivative of benzoic acid featuring a trifluoromethyl group at the meta position. This compound typically appears as a white to off-white solid and is soluble in water due to the presence of the sodium ion, which enhances its ionic character. The trifluoromethyl group contributes to the compound's unique chemical properties, including increased lipophilicity and potential biological activity. As a salt, it may exhibit different reactivity compared to its parent acid, particularly in terms of acidity and solubility. This compound is often utilized in various applications, including as a reagent in organic synthesis and in the study of fluorinated compounds. Its stability and reactivity can be influenced by environmental factors such as pH and temperature. Overall, benzoic acid, 3-(trifluoromethyl)-, sodium salt is an important compound in both industrial and research settings, particularly in the fields of pharmaceuticals and agrochemicals.
Formula:C8H4F3NaO2
InChI:InChI=1/C8H5F3O2.Na/c9-8(10,11)6-3-1-2-5(4-6)7(12)13;/h1-4H,(H,12,13);/q;+1/p-1
InChI key:InChIKey=XGJBRIYCQDWDHD-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=CC(C(O)=O)=CC=C1.[Na]
Synonyms:
  • 3-(Trifluoromethyl)benzoic acid sodium salt
  • Benzoic acid, 3-(trifluoromethyl)-, sodium salt
  • Benzoic acid, 3-(trifluoromethyl)-, sodium salt (1:1)
  • Sodium 3-(trifluoromethyl)benzoate
  • Sodium 3-trifluoromethylbenzoate
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