1,1,2-tris(3-chloranyl-4-methyl-phenyl)hexylboron(1-)

Systemtic Name: 1,1,2-tris(3-chloranyl-4-methyl-phenyl)hexylboron(1-) Openeye Name: 1,1,2-tris(3-chloro-4-methyl-phenyl)hexylboron(1-) CAS Name: 1,1,2-tris(3-chloro-4-methylphenyl)hexylboron(1-) IUPAC Name: 1,1,2-tris(3-chloro-4-methylphenyl)hexylboron(1-) Traditional Name: 1,1,2-tris(3-chloro-4-methyl-phenyl)hexylboron(1-) Formula: C27H28BCl3- MolecularWeight: 469.68122

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Descriptors Computed from Structure

Canonical SMILES:

[B-]C(C1=CC(=C(C=C1)C)Cl)(C2=CC(=C(C=C2)C)Cl)C(CCCC)C3=CC(=C(C=C3)C)Cl

Isomeric SMILES

[B-]C(C1=CC(=C(C=C1)C)Cl)(C2=CC(=C(C=C2)C)Cl)C(CCCC)C3=CC(=C(C=C3)C)Cl

InChI

InChI=1S/C27H28BCl3/c1-5-6-7-23(20-11-8-17(2)24(29)14-20)27(28,21-12-9-18(3)25(30)15-21)22-13-10-19(4)26(31)16-22/h8-16,23H,5-7H2,1-4H3/q-1