1,1,2-tris(2-methylphenyl)hexoxyboronic acid

Systemtic Name: 1,1,2-tris(2-methylphenyl)hexoxyboronic acid Openeye Name: 1,1,2-tris(o-tolyl)hexoxyboronic acid CAS Name: 1,1,2-tris(2-methylphenyl)hexoxyboronic acid IUPAC Name: 1,1,2-tris(2-methylphenyl)hexoxyboronic acid Traditional Name: 1,1,2-tris(o-tolyl)hexoxyboronic acid Formula: C27H33BO3 MolecularWeight: 416.36012

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Descriptors Computed from Structure

Canonical SMILES:

B(O)(O)OC(C1=CC=CC=C1C)(C2=CC=CC=C2C)C(CCCC)C3=CC=CC=C3C

Isomeric SMILES

B(O)(O)OC(C1=CC=CC=C1C)(C2=CC=CC=C2C)C(CCCC)C3=CC=CC=C3C

InChI

InChI=1S/C27H33BO3/c1-5-6-17-26(23-16-10-7-13-20(23)2)27(31-28(29)30,24-18-11-8-14-21(24)3)25-19-12-9-15-22(25)4/h7-16,18-19,26,29-30H,5-6,17H2,1-4H3