oct-1-yne; oxidanyl(oxidanylidene)titanium; propan-2-ol

Systemtic Name: oct-1-yne; oxidanyl(oxidanylidene)titanium; propan-2-ol Openeye Name: hydroxy(oxo)titanium; oct-1-yne; propan-2-ol CAS Name: hydroxy(oxo)titanium; 1-octyne; 2-propanol IUPAC Name: hydroxy(oxo)titanium; oct-1-yne; propan-2-ol Traditional Name: hydroxy(keto)titanium; oct-1-yne; propan-2-ol Formula: C27H48O3Ti-3 MolecularWeight: 468.53522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#[C-].CCCCCCC#[C-].CCCCCCC#[C-].CC(C)O.O[Ti]=O

Isomeric SMILES

CCCCCCC#[C-].CCCCCCC#[C-].CCCCCCC#[C-].CC(C)O.O[Ti]=O

InChI

InChI=1S/3C8H13.C3H8O.H2O.O.Ti/c3*1-3-5-7-8-6-4-2;1-3(2)4;;;/h3*3,5-8H2,1H3;3-4H,1-2H3;1H2;;/q3*-1;;;;+1/p-1