Titanium(IV) oxyacetylacetonate

Catalog Number	ACM14024647-3
CAS	14024-64-7
Structure
Synonyms	Bis(2,4-pentanedionato) titanium
IUPAC Name	4-Hydroxypent-3-en-2-one;oxotitanium
Molecular Weight	264.1
Molecular Formula	C10H16O5Ti
Canonical SMILES	CC(=CC(=O)C)O.CC(=CC(=O)C)O.O=[Ti]
InChI	InChI=1S/2C5H8O2.O.Ti/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;
InChI Key	ADVORQMAWLEPOI-UHFFFAOYSA-N
Boiling Point	159.5 °C
Melting Point	200 °C
Purity	95%+
Appearance	Light orange powder
Storage	Store below +30 °C
Complexity	253
Covalently-Bonded Unit Count	3
EC Number	237-861-9
Exact Mass	264.0477143
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Monoisotopic Mass	264.0477143
Rotatable Bond Count	2
Topological Polar Surface Area	91.7 Ų