tris[2,3,5,6-tetramethyl-4-(4-phenylphenyl)phenyl]borane

Systemtic Name: tris[2,3,5,6-tetramethyl-4-(4-phenylphenyl)phenyl]borane Openeye Name: tris[2,3,5,6-tetramethyl-4-(4-phenylphenyl)phenyl]borane CAS Name: tris[2,3,5,6-tetramethyl-4-(4-phenylphenyl)phenyl]borane IUPAC Name: tris[2,3,5,6-tetramethyl-4-(4-phenylphenyl)phenyl]borane Traditional Name: tris[2,3,5,6-tetramethyl-4-(4-phenylphenyl)phenyl]borane Formula: C66H63B MolecularWeight: 867.01742

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=C(C(=C(C(=C1C)C)C2=CC=C(C=C2)C3=CC=CC=C3)C)C)(C4=C(C(=C(C(=C4C)C)C5=CC=C(C=C5)C6=CC=CC=C6)C)C)C7=C(C(=C(C(=C7C)C)C8=CC=C(C=C8)C9=CC=CC=C9)C)C

Isomeric SMILES

B(C1=C(C(=C(C(=C1C)C)C2=CC=C(C=C2)C3=CC=CC=C3)C)C)(C4=C(C(=C(C(=C4C)C)C5=CC=C(C=C5)C6=CC=CC=C6)C)C)C7=C(C(=C(C(=C7C)C)C8=CC=C(C=C8)C9=CC=CC=C9)C)C

InChI

InChI=1S/C66H63B/c1-40-46(7)64(47(8)41(2)61(40)58-34-28-55(29-35-58)52-22-16-13-17-23-52)67(65-48(9)42(3)62(43(4)49(65)10)59-36-30-56(31-37-59)53-24-18-14-19-25-53)66-50(11)44(5)63(45(6)51(66)12)60-38-32-57(33-39-60)54-26-20-15-21-27-54/h13-39H,1-12H3