1331753-65-1

Basic information

• Product Name: bis-[p-(prop-2-ynyloxy)-benzyl-cyclopentadienyl] titanium(IV) dichloride
• CAS NO: 1331753-65-1
• Molecular Weight: 537.321
• Mol File: 1331753-65-1.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: bis-[p-(prop-2-ynyloxy)-benzyl-cyclopentadienyl] titanium(IV) dichloride(CAS DataBase Reference)
• NIST Chemistry Reference: bis-[p-(prop-2-ynyloxy)-benzyl-cyclopentadienyl] titanium(IV) dichloride(1331753-65-1)
• EPA Substance Registry System: bis-[p-(prop-2-ynyloxy)-benzyl-cyclopentadienyl] titanium(IV) dichloride(1331753-65-1)

Safety Data

• Hazardous Substances Data: 1331753-65-1(Hazardous Substances Data)

Upstream product

• 7550-45-0 titanium tetrachloride 

Downstream Products

• 1331753-66-2 bis-([2-(4-((1-(2-(1-methoxy-1-oxo-3-phenylpropan-2-ylamino)-2-oxoethyl)-1H-1,2,3-triazol-4-yl)methoxy)-benzyl)]-cyclopentadienyl) titanium(IV) dichloride 

Relevant articles and documents

Towards peptide-substituted titanocene anticancer drugs

An alkyne-substituted fulvene was transformed via hydridolithiation followed by transmetallation with titanium tetrachloride into bis-[p-(prop-2-ynyloxy)-benzyl-cyclopentadienyl] titanium(IV) dichloride. Single crystals of this titanocene derivative could be obtained and the structure determined by X-ray diffraction. It showed that this compound crystallises in the space group C2/c with four molecules in the monoclinic cell. The alkyne-substituted titanocene dichloride derivative was then subject to a copper-catalysed azide-alkyne cycloaddition with its azide-functionalised methylester-protected phenylalanine reaction partner in order to form a linking triazole. This reaction was performed under anhydrous conditions employing a dichloromethane/acetonitrile solvent mixture with copper(I) iodide and 2,6-lutidine as the catalyst system. Under these conditions the adduct between the protein mimic and the titanocene was formed without hydrolysing the titanium dichloride moiety.