bis(oxidanyl)-oxidanylidene-titanium; dioctyl hydrogen phosphate; propane

Systemtic Name: bis(oxidanyl)-oxidanylidene-titanium; dioctyl hydrogen phosphate; propane Openeye Name: dihydroxy(oxo)titanium; dioctyl hydrogen phosphate; propane CAS Name: dihydroxy(oxo)titanium; dioctyl hydrogen phosphate; propane IUPAC Name: dihydroxy(oxo)titanium; dioctyl hydrogen phosphate; propane Traditional Name: dihydroxy(keto)titanium; dioctyl hydrogen phosphate; propane Formula: C51H114O15P3Ti- MolecularWeight: 1108.230143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOP(=O)(O)OCCCCCCCC.CCCCCCCCOP(=O)(O)OCCCCCCCC.CCCCCCCCOP(=O)(O)OCCCCCCCC.C[CH-]C.O[Ti](=O)O

Isomeric SMILES

CCCCCCCCOP(=O)(O)OCCCCCCCC.CCCCCCCCOP(=O)(O)OCCCCCCCC.CCCCCCCCOP(=O)(O)OCCCCCCCC.C[CH-]C.O[Ti](=O)O

InChI

InChI=1S/3C16H35O4P.C3H7.2H2O.O.Ti/c3*1-3-5-7-9-11-13-15-19-21(17,18)20-16-14-12-10-8-6-4-2;1-3-2;;;;/h3*3-16H2,1-2H3,(H,17,18);3H,1-2H3;2*1H2;;/q;;;-1;;;;+2/p-2