aluminum bis(4-dodecylphenyl) phosphate

Systemtic Name: aluminum bis(4-dodecylphenyl) phosphate Openeye Name: aluminum bis(4-dodecylphenyl) phosphate CAS Name: aluminum bis(4-dodecylphenyl) phosphate IUPAC Name: aluminum bis(4-dodecylphenyl) phosphate Traditional Name: aluminum bis(4-laurylphenyl) phosphate Formula: C108H174AlO12P3 MolecularWeight: 1784.432781

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)OP(=O)([O-])OC2=CC=C(C=C2)CCCCCCCCCCCC.CCCCCCCCCCCCC1=CC=C(C=C1)OP(=O)([O-])OC2=CC=C(C=C2)CCCCCCCCCCCC.CCCCCCCCCCCCC1=CC=C(C=C1)OP(=O)([O-])OC2=CC=C(C=C2)CCCCCCCCCCCC.[Al+3]

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)OP(=O)([O-])OC2=CC=C(C=C2)CCCCCCCCCCCC.CCCCCCCCCCCCC1=CC=C(C=C1)OP(=O)([O-])OC2=CC=C(C=C2)CCCCCCCCCCCC.CCCCCCCCCCCCC1=CC=C(C=C1)OP(=O)([O-])OC2=CC=C(C=C2)CCCCCCCCCCCC.[Al+3]

InChI

InChI=1S/3C36H59O4P.Al/c3*1-3-5-7-9-11-13-15-17-19-21-23-33-25-29-35(30-26-33)39-41(37,38)40-36-31-27-34(28-32-36)24-22-20-18-16-14-12-10-8-6-4-2;/h3*25-32H,3-24H2,1-2H3,(H,37,38);/q;;;+3/p-3