bis(oxidanyl)-oxidanylidene-titanium; ditridecyl hydrogen phosphate; octane; octane

Systemtic Name: bis(oxidanyl)-oxidanylidene-titanium; ditridecyl hydrogen phosphate; octane; octane Openeye Name: dihydroxy(oxo)titanium; ditridecyl hydrogen phosphate; octane; octane CAS Name: dihydroxy(oxo)titanium; ditridecyl hydrogen phosphate; octane; octane IUPAC Name: dihydroxy(oxo)titanium; ditridecyl hydrogen phosphate; octane; octane Traditional Name: dihydroxy(keto)titanium; ditridecyl hydrogen phosphate; n-octane; octane Formula: C84H183O11P2Ti- MolecularWeight: 1479.159742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC.CCCCCCCC.CCCCCCCC.CCCCCCC[CH2-].CCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCC.CCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCC.O[Ti](=O)O

Isomeric SMILES

CCCCCCCC.CCCCCCCC.CCCCCCCC.CCCCCCC[CH2-].CCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCC.CCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCC.O[Ti](=O)O

InChI

InChI=1S/2C26H55O4P.3C8H18.C8H17.2H2O.O.Ti/c2*1-3-5-7-9-11-13-15-17-19-21-23-25-29-31(27,28)30-26-24-22-20-18-16-14-12-10-8-6-4-2;4*1-3-5-7-8-6-4-2;;;;/h2*3-26H2,1-2H3,(H,27,28);3*3-8H2,1-2H3;1,3-8H2,2H3;2*1H2;;/q;;;;;-1;;;;+2/p-2