dialuminum [5-ethyl-2,7-dimethyl-4,5-bis(2-methylpropyl)octan-4-yl]-bis(oxidanidyl)borane

Systemtic Name: dialuminum [5-ethyl-2,7-dimethyl-4,5-bis(2-methylpropyl)octan-4-yl]-bis(oxidanidyl)borane Openeye Name: dialuminum (2-ethyl-1,1,2-triisobutyl-4-methyl-pentyl)-dioxido-borane CAS Name: dialuminum [5-ethyl-2,7-dimethyl-4,5-bis(2-methylpropyl)octan-4-yl]-dioxidoborane IUPAC Name: dialuminum [5-ethyl-2,7-dimethyl-4,5-bis(2-methylpropyl)octan-4-yl]-dioxidoborane Traditional Name: dialuminum (2-ethyl-1,1,2-triisobutyl-4-methyl-pentyl)-dioxido-borane Formula: C60H123Al2B3O6 MolecularWeight: 1027.011096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C20H41BO2.2Al/c3*1-10-19(11-15(2)3,12-16(4)5)20(21(22)23,13-17(6)7)14-18(8)9;;/h3*15-18H,10-14H2,1-9H3;;/q3*-2;2*+3