bis(6-methylheptyl) phosphate; titanium(4+)

Systemtic Name: bis(6-methylheptyl) phosphate; titanium(4+) Openeye Name: bis(6-methylheptyl) phosphate; titanium(4+) CAS Name: bis(6-methylheptyl) phosphate; titanium(4+) IUPAC Name: bis(6-methylheptyl) phosphate; titanium(4+) Traditional Name: bis(6-methylheptyl) phosphate; titanium(4+) Formula: C64H136O16P4Ti MolecularWeight: 1333.517084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCOP(=O)([O-])OCCCCCC(C)C.CC(C)CCCCCOP(=O)([O-])OCCCCCC(C)C.CC(C)CCCCCOP(=O)([O-])OCCCCCC(C)C.CC(C)CCCCCOP(=O)([O-])OCCCCCC(C)C.[Ti+4]

Isomeric SMILES

CC(C)CCCCCOP(=O)([O-])OCCCCCC(C)C.CC(C)CCCCCOP(=O)([O-])OCCCCCC(C)C.CC(C)CCCCCOP(=O)([O-])OCCCCCC(C)C.CC(C)CCCCCOP(=O)([O-])OCCCCCC(C)C.[Ti+4]

InChI

InChI=1S/4C16H35O4P.Ti/c4*1-15(2)11-7-5-9-13-19-21(17,18)20-14-10-6-8-12-16(3)4;/h4*15-16H,5-14H2,1-4H3,(H,17,18);/q;;;;+4/p-4