CAS 13170-05-3

Bis[4-(1,1-dimethylethyl)benzoato-κO]hydroxyaluminum

Description:

Bis[4-(1,1-dimethylethyl)benzoato-κO]hydroxyaluminum, with the CAS number 13170-05-3, is a coordination compound featuring aluminum as the central metal atom coordinated to two bidentate benzoate ligands. The structure includes bulky tert-butyl groups on the aromatic rings, which enhance steric hindrance and influence the compound's solubility and reactivity. This compound is typically characterized by its aluminum-oxygen coordination, which can exhibit Lewis acid behavior, making it useful in various chemical applications, including catalysis and materials science. The presence of hydroxyl groups contributes to its potential reactivity and interaction with other chemical species. Additionally, the compound may display interesting thermal and chemical stability due to the steric protection offered by the tert-butyl groups. Its synthesis often involves the reaction of aluminum salts with the corresponding benzoic acid derivatives, and it may be analyzed using techniques such as NMR, IR spectroscopy, and X-ray crystallography to elucidate its structure and confirm its properties.

Formula: C₂₂H₂₇AlO₅

InChI: InChI=1S/2C11H14O2.Al.H2O/c2*1-11(2,3)9-6-4-8(5-7-9)10(12)13;;/h2*4-7H,1-3H3,(H,12,13);;1H2/q;;+3;/p-3

InChI key: InChIKey=OYFUVZBROQZLCL-UHFFFAOYSA-K

SMILES: C(O[Al](OC(=O)C1=CC=C(C(C)(C)C)C=C1)O)(=O)C2=CC=C(C(C)(C)C)C=C2

Synonyms:

• 4-Tert-Butylbenzoic Acid - Aluminum (2:1) Hydrate
• Al-Ptbba
• Al-Ptbba 500
• Alptbb 300
• Aluminum hydroxy-di-p-tert-butylbenzoate
• Aluminum hydroxybis[4-(tert-butyl)benzoate]
• Aluminum, bis(p-tert-butylbenzoato)hydroxy-
• Aluminum, bis[4-(1,1-dimethylethyl)benzoato-O]hydroxy-
• Aluminum, bis[4-(1,1-dimethylethyl)benzoato-κO]hydroxy-
• Benzoic acid, 4-(1,1-dimethylethyl)-, aluminum complex
• Bis(4-Tert-Butyl-Benzoate)Aluminum Hydroxide
• Bis(p-tert-butyl benzoate)hydroxyaluminum
• Bis[4-(1,1-dimethylethyl)benzoato-κO]hydroxyaluminum
• Chb 3C
• Hydroxyaluminum bis(p-tert-butylbenzoate)
• Nucleating agent 4030
• S 4030
• Sandostab 4030