Titanium diisopropoxide bis(tetramethylheptanedionate)

Catalog Number	ACM144665269-1
CAS	144665-26-9
Structure
Synonyms	Di(iso-propoxide)bis(2,2,6,6-tetramethyl-3,5-heptanedionato)titanium(IV)
IUPAC Name	5-Hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;propan-2-ol;titanium
Molecular Weight	536.6
Molecular Formula	C28H56O6Ti
Canonical SMILES	CC(C)O.CC(C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.[Ti]
InChI	InChI=1S/2C11H20O2.2C3H8O.Ti/c2*1-10(2,3)8(12)7-9(13)11(4,5)6;2*1-3(2)4;/h2*7,12H,1-6H3;2*3-4H,1-2H3;
InChI Key	JVUATZXZNIJLPZ-UHFFFAOYSA-N
Boiling Point	150 °C/1mmHg (lit.)
Melting Point	171.1-184.6 °C
Flash Point	>110 °C
Purity	95%+
Appearance	White powder
Complexity	589
Exact Mass	536.3556302
Heavy Atom Count	35
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	4
Monoisotopic Mass	536.3556302
Rotatable Bond Count	6
Topological Polar Surface Area	115 Ų