Aluminium 4-(1,1-Dimethylethyl)Benzoate
[CAS# 4067-14-5]

Identification

• Name: Aluminium 4-(1,1-Dimethylethyl)Benzoate
• Synonyms: Benzoic Acid, 4-(1,1-Dimethylethyl)-, Aluminum Salt; Aluminium 4-(1,1-Dimethylethyl)Benzoate
• Molecular Formula: C₃₃H₃₉AlO₆
• Molecular Weight: 558.65
• CAS Registry Number: 4067-14-5
• EINECS: 223-774-3
• SMILES: C1=C(C(C)(C)C)C=CC(=C1)C([O-])=O.C2=C(C(C)(C)C)C=CC(=C2)C([O-])=O.[O-]C(=O)C3=CC=C(C(C)(C)C)C=C3.[Al+3]
• InChI: 1S/3C11H14O2.Al/c3*1-11(2,3)9-6-4-8(5-7-9)10(12)13;/h3*4-7H,1-3H3,(H,12,13);/q;;;+3/p-3
• InChIKey: ZGNIGAHODXRWIT-UHFFFAOYSA-K

Properties

• Boiling point: 283.3°C at 760 mmHg (Cal.)
• Flash point: 134.9°C (Cal.)