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Titanium tetrabutoxide

Catalog Number ACM5593704-4
CAS 5593-70-4
Structure Titanium tetrabutoxide
Synonyms Tetrabutyl titanate
IUPAC Name Butan-1-olate;titanium(4+)
Molecular Weight 340.32
Molecular Formula C16H36O4Ti
Canonical SMILES CCCC[O-].CCCC[O-].CCCC[O-].CCCC[O-].[Ti+4]
InChI InChI=1S/4C4H9O.Ti/c4*1-2-3-4-5;/h4*2-4H2,1H3;/q4*-1;+4
InChI Key YHWCPXVTRSHPNY-UHFFFAOYSA-N
Boiling Point 206 °C
Melting Point -55 °C
Flash Point 55 °F
Purity 95%+
Density 1.00 g/mL at 20 °C (lit.)
Solubility Miscible with aliphatic, aromatic, chlorinated and oxygenated solvents
Appearance Pale yellow liquid
Storage Store at +2 °C to +8 °C
Complexity 13.1
Exact Mass 340.2093003
Heavy Atom Count 21
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
Monoisotopic Mass 340.2093003
Odor Alcohol-like odor
Rotatable Bond Count 8
Topological Polar Surface Area 92.2 Ų

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