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Titanium(IV) butoxide

Catalog Number
ACM5593704-2
CAS Number
5593-70-4
Product Name
Titanium(IV) butoxide
Structure
Category
Solution Deposition Precursors
Description
Tetrabutyl titanate appears as a water-white to pale-yellow liquid with an alcohol-like odor. About the same density as water. Flash point 170°F. Contact may irritate or cause burns.;Liquid; WetSolid
IUPAC Name
butan-1-olate;titanium(4+)
Molecular Weight
340.32g/mol
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
593 °F at 760 mm Hg (USCG, 1999);312 °C
Melting Point
-67 °F (USCG, 1999);-55 °C
Flash Point
170 °F (USCG, 1999);170 °F (CLOSED CUP)
Density
0.998 at 77 °F (USCG, 1999);0.998 @ 25 °C (liquid)
Solubility
Sol in most organic solvents except ketones;Sol in aliphatic aromatic, chlorinated, and oxygenated solvents
Color/Form
COLORLESS TO LIGHT-YELLOW LIQUID;Pale yellow, viscous liquid
Complexity
13.1
Covalently-Bonded Unit Count
5
EC Number
227-006-8
Exact Mass
340.209301g/mol
Formal Charge
0
Heat of Vaporization
79 CAL/G
Heavy Atom Count
21
MeSH Entry Terms
1-butanol, titanium(4+) salt;tetrabutoxy titanium;tetrabutoxy titanium dimer;tetrabutoxy titanium homopolymer;tetrabutoxy titanium tetramer;titanium tetrabutoxide
Monoisotopic Mass
340.209301g/mol
Odor
WEAK, ALCOHOL-LIKE ODOR
Other Experimental
REACTS WITH WATER TO FORM BUTANOL AND TITANIUM DIOXIDE;Forms a glass below -55 °C; decomp in water
Refractive Index
Index of refraction: 1.486
Rotatable Bond Count
8
UNII
FJS8Q2MX9I
UN Number
2920
Vapor Density
11.7 (Air= 1)
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