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CAS 10196-68-6

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Benzoic acid, 4-(1,1-dimethylethyl)-, barium salt (2:1)

Description:
Benzoic acid, 4-(1,1-dimethylethyl)-, barium salt (2:1), commonly referred to as barium 4-tert-butylbenzoate, is an organic compound characterized by its barium salt form of 4-tert-butylbenzoic acid. This substance typically appears as a white to off-white solid and is soluble in organic solvents while exhibiting limited solubility in water. The presence of the barium ion contributes to its potential applications in various fields, including as a stabilizer in plastics and as a reagent in organic synthesis. The tert-butyl group enhances the hydrophobic character of the molecule, influencing its reactivity and interaction with other compounds. Additionally, the compound may exhibit antimicrobial properties, making it of interest in food preservation and other applications. Safety data should be consulted, as barium salts can pose health risks if ingested or improperly handled. Overall, this compound serves as a notable example of how modifications to a benzoic acid structure can lead to diverse chemical properties and applications.
Formula:C11H14O2Ba
InChI:InChI=1S/C11H14O2.Ba/c1-11(2,3)9-6-4-8(5-7-9)10(12)13;/h4-7H,1-3H3,(H,12,13);
InChI key:InChIKey=YQXNECZTQCOUHB-UHFFFAOYSA-N
SMILES:C(C)(C)(C)C1=CC=C(C(O)=O)C=C1.[Ba]
Synonyms:
  • Benzoic acid, 4-(1,1-dimethylethyl)-, barium salt (2:1)
  • Benzoic acid, 4-(1,1-dimethylethyl)-, barium salt
  • Barium p-tert-butylbenzoate
  • Benzoic acid, 4-(1,1-dimethylethyl)-, barium salt (2:1)
  • p-tert-Butylbenzoic acid barium salt
  • Barium p-tert-butylbenzoate
  • barium bis(4-tert-butylbenzoate)
  • Benzoic acid, p-tert-butyl-, barium salt
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