Bis(2,2,6,6-tetramethyl-3,5-heptanedionato)oxotitanium(IV)

Base Information

• Chemical Name: Bis(2,2,6,6-tetramethyl-3,5-heptanedionato)oxotitanium(IV)
• CAS No.: 152248-67-4
• Molecular Formula: C22H38 O5 Ti
• Molecular Weight: 430.4
• European Community (EC) Number: 695-601-3
• Mol file: 152248-67-4.mol

Synonyms:152248-67-4;Bis(2,2,6,6-tetramethyl-3,5-heptanedionato)oxotitanium(IV);(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;oxotitanium;Oxobis(2,2,6,6-tetramethyl-3,5-heptanedionato)titanium(IV);XIKXPWMOEGTKNT-ZJCTYWPYSA-N;MFCD01320917;Oxobis(2,2,6,6-tetramethyl-3,5-heptanedionato)titanium(IV), 95%

Chemical Property of Bis(2,2,6,6-tetramethyl-3,5-heptanedionato)oxotitanium(IV)

Chemical Property:

• Melting Point: 120°C (dec.)
• PSA: 69.67000
• LogP: 5.90620
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 432.2355150
• Heavy Atom Count: 28
• Complexity: 522

Purity/Quality:

98%min ^*data from raw suppliers

Bis(2,2,6,6-tetramethyl-3,5-heptanedionato)oxotitanium(IV), min. 95% [OTi(TMHD)2] ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C(=CC(=O)C(C)(C)C)O.CC(C)(C)C(=CC(=O)C(C)(C)C)O.O=[Ti]
• Isomeric SMILES: CC(/C(=C/C(=O)C(C)(C)C)/O)(C)C.CC(/C(=C/C(=O)C(C)(C)C)/O)(C)C.O=[Ti]