bis(oxidanyl)-oxidanylidene-titanium; [butoxy(oxidanyl)phosphoryl] octyl hydrogen phosphate; [butoxy(oxidanyl)phosphoryl] octyl propan-2-yl phosphate

Systemtic Name: bis(oxidanyl)-oxidanylidene-titanium; [butoxy(oxidanyl)phosphoryl] octyl hydrogen phosphate; [butoxy(oxidanyl)phosphoryl] octyl propan-2-yl phosphate Openeye Name: [butoxy(hydroxy)phosphoryl] isopropyl octyl phosphate; [butoxy(hydroxy)phosphoryl] octyl hydrogen phosphate; dihydroxy(oxo)titanium CAS Name: [butoxy(hydroxy)phosphoryl] octyl hydrogen phosphate; dihydroxy(oxo)titanium; phosphoric acid [butoxy(hydroxy)phosphoryl] octyl propan-2-yl ester IUPAC Name: [butoxy(hydroxy)phosphoryl] octyl hydrogen phosphate; [butoxy(hydroxy)phosphoryl] octyl propan-2-yl phosphate; dihydroxy(oxo)titanium Traditional Name: [butoxy(hydroxy)phosphoryl] octyl hydrogen phosphate; dihydroxy(keto)titanium; phosphoric acid [butoxy(hydroxy)phosphoryl] isopropyl octyl ester Formula: C39H92O24P6Ti MolecularWeight: 1178.842946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOP(=O)(O)OP(=O)(O)OCCCC.CCCCCCCCOP(=O)(O)OP(=O)(O)OCCCC.CCCCCCCCOP(=O)(OC(C)C)OP(=O)(O)OCCCC.O[Ti](=O)O

Isomeric SMILES

CCCCCCCCOP(=O)(O)OP(=O)(O)OCCCC.CCCCCCCCOP(=O)(O)OP(=O)(O)OCCCC.CCCCCCCCOP(=O)(OC(C)C)OP(=O)(O)OCCCC.O[Ti](=O)O

InChI

InChI=1S/C15H34O7P2.2C12H28O7P2.2H2O.O.Ti/c1-5-7-9-10-11-12-14-20-24(18,21-15(3)4)22-23(16,17)19-13-8-6-2;2*1-3-5-7-8-9-10-12-18-21(15,16)19-20(13,14)17-11-6-4-2;;;;/h15H,5-14H2,1-4H3,(H,16,17);2*3-12H2,1-2H3,(H,13,14)(H,15,16);2*1H2;;/q;;;;;;+2/p-2