bis(oxidanyl)-oxidanylidene-titanium; 2-ethyl-3-oxidanylidene-butanoic acid; propan-2-ol

Systemtic Name: bis(oxidanyl)-oxidanylidene-titanium; 2-ethyl-3-oxidanylidene-butanoic acid; propan-2-ol Openeye Name: dihydroxy(oxo)titanium; 2-ethyl-3-oxo-butanoic acid; propan-2-ol CAS Name: dihydroxy(oxo)titanium; 2-ethyl-3-oxobutanoic acid; 2-propanol IUPAC Name: dihydroxy(oxo)titanium; 2-ethyl-3-oxobutanoic acid; propan-2-ol Traditional Name: dihydroxy(keto)titanium; 2-ethyl-3-keto-butyric acid; propan-2-ol Formula: C18H38O11Ti MolecularWeight: 478.35472

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C)C(=O)O.CCC(C(=O)C)C(=O)O.CC(C)O.CC(C)O.O[Ti](=O)O

Isomeric SMILES

CCC(C(=O)C)C(=O)O.CCC(C(=O)C)C(=O)O.CC(C)O.CC(C)O.O[Ti](=O)O

InChI

InChI=1S/2C6H10O3.2C3H8O.2H2O.O.Ti/c2*1-3-5(4(2)7)6(8)9;2*1-3(2)4;;;;/h2*5H,3H2,1-2H3,(H,8,9);2*3-4H,1-2H3;2*1H2;;/q;;;;;;;+2/p-2