aluminum 4-tert-butylphenolate

Systemtic Name: aluminum 4-tert-butylphenolate Openeye Name: aluminum 4-tert-butylphenolate CAS Name: aluminum 4-tert-butylphenolate IUPAC Name: aluminum 4-tert-butylphenolate Traditional Name: aluminum 4-tert-butylphenolate Formula: C30H39AlO3 MolecularWeight: 474.610398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)[O-].CC(C)(C)C1=CC=C(C=C1)[O-].CC(C)(C)C1=CC=C(C=C1)[O-].[Al+3]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)[O-].CC(C)(C)C1=CC=C(C=C1)[O-].CC(C)(C)C1=CC=C(C=C1)[O-].[Al+3]

InChI

InChI=1S/3C10H14O.Al/c3*1-10(2,3)8-4-6-9(11)7-5-8;/h3*4-7,11H,1-3H3;/q;;;+3/p-3