2,2-diethylpropane-1,3-diol; 2-ethylhexan-1-ol; titanium

Systemtic Name: 2,2-diethylpropane-1,3-diol; 2-ethylhexan-1-ol; titanium Openeye Name: 2,2-diethylpropane-1,3-diol; 2-ethylhexan-1-ol; titanium CAS Name: 2,2-diethylpropane-1,3-diol; 2-ethyl-1-hexanol; titanium IUPAC Name: 2,2-diethylpropane-1,3-diol; 2-ethylhexan-1-ol; titanium Traditional Name: 2,2-diethylpropane-1,3-diol; 2-ethylhexan-1-ol; titanium Formula: C23H52O4Ti MolecularWeight: 440.52358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CO.CCCCC(CC)CO.CCC(CC)(CO)CO.[Ti]

Isomeric SMILES

CCCCC(CC)CO.CCCCC(CC)CO.CCC(CC)(CO)CO.[Ti]

InChI

InChI=1S/2C8H18O.C7H16O2.Ti/c2*1-3-5-6-8(4-2)7-9;1-3-7(4-2,5-8)6-9;/h2*8-9H,3-7H2,1-2H3;8-9H,3-6H2,1-2H3;