diphenyl phosphate; tetrakis(4-tert-butylphenyl)phosphanium

Systemtic Name: diphenyl phosphate; tetrakis(4-tert-butylphenyl)phosphanium Openeye Name: diphenyl phosphate; tetrakis(4-tert-butylphenyl)phosphonium CAS Name: diphenyl phosphate; tetrakis(4-tert-butylphenyl)phosphonium IUPAC Name: diphenyl phosphate; tetrakis(4-tert-butylphenyl)phosphanium Traditional Name: diphenyl phosphate; tetrakis(4-tert-butylphenyl)phosphonium Formula: C52H62O4P2 MolecularWeight: 812.993802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)[P+](C2=CC=C(C=C2)C(C)(C)C)(C3=CC=C(C=C3)C(C)(C)C)C4=CC=C(C=C4)C(C)(C)C.C1=CC=C(C=C1)OP(=O)([O-])OC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)[P+](C2=CC=C(C=C2)C(C)(C)C)(C3=CC=C(C=C3)C(C)(C)C)C4=CC=C(C=C4)C(C)(C)C.C1=CC=C(C=C1)OP(=O)([O-])OC2=CC=CC=C2

InChI

InChI=1S/C40H52P.C12H11O4P/c1-37(2,3)29-13-21-33(22-14-29)41(34-23-15-30(16-24-34)38(4,5)6,35-25-17-31(18-26-35)39(7,8)9)36-27-19-32(20-28-36)40(10,11)12;13-17(14,15-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h13-28H,1-12H3;1-10H,(H,13,14)/q+1;/p-1