tris(13-propylpentacosan-13-yl) phosphate

Systemtic Name: tris(13-propylpentacosan-13-yl) phosphate Openeye Name: tris(1-dodecyl-1-propyl-tridecyl) phosphate CAS Name: phosphoric acid tris(13-propylpentacosan-13-yl) ester IUPAC Name: tris(13-propylpentacosan-13-yl) phosphate Traditional Name: phosphoric acid tris(1-lauryl-1-propyl-tridecyl) ester Formula: C84H171O4P MolecularWeight: 1276.227901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCC)(CCCCCCCCCCCC)OP(=O)(OC(CCC)(CCCCCCCCCCCC)CCCCCCCCCCCC)OC(CCC)(CCCCCCCCCCCC)CCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC(CCC)(CCCCCCCCCCCC)OP(=O)(OC(CCC)(CCCCCCCCCCCC)CCCCCCCCCCCC)OC(CCC)(CCCCCCCCCCCC)CCCCCCCCCCCC

InChI

InChI=1S/C84H171O4P/c1-10-19-25-31-37-43-49-55-61-67-76-82(73-16-7,77-68-62-56-50-44-38-32-26-20-11-2)86-89(85,87-83(74-17-8,78-69-63-57-51-45-39-33-27-21-12-3)79-70-64-58-52-46-40-34-28-22-13-4)88-84(75-18-9,80-71-65-59-53-47-41-35-29-23-14-5)81-72-66-60-54-48-42-36-30-24-15-6/h10-81H2,1-9H3