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CAS 329735-75-3

:

[(1,2,3,4,5-η)-1-Butyl-2,4-cyclopentadien-1-yl]trichlorozirconium

Description:
The chemical substance known as [(1,2,3,4,5-η)-1-Butyl-2,4-cyclopentadien-1-yl]trichlorozirconium, with the CAS number 329735-75-3, is a coordination compound featuring a zirconium center coordinated to a cyclopentadienyl ligand and three chlorides. This compound exhibits characteristics typical of organometallic complexes, including the ability to participate in various chemical reactions, such as polymerization processes. The presence of the butyl group enhances its solubility in organic solvents, making it useful in synthetic applications. The cyclopentadienyl moiety provides stability and contributes to the overall electronic properties of the compound. As a zirconium-based complex, it may also exhibit catalytic activity, particularly in olefin polymerization. Its structure allows for potential reactivity with other ligands or substrates, making it a subject of interest in materials science and organometallic chemistry. Safety and handling precautions should be observed due to the presence of chlorine atoms, which can pose hazards in terms of reactivity and toxicity.
Formula:C9H13Cl3Zr
InChI:InChI=1S/C9H13.3ClH.Zr/c1-2-3-6-9-7-4-5-8-9;;;;/h4-5,7-8H,2-3,6H2,1H3;3*1H;/q-1;;;;+4/p-3
InChI key:InChIKey=YVTQTAXAROWHJR-UHFFFAOYSA-K
SMILES:[Cl-][Zr+4]1234([Cl-])([Cl-])[C-]5(CCCC)[CH]1=[CH]2[CH]3=[CH]45
Synonyms:
  • [(1,2,3,4,5-η)-1-Butyl-2,4-cyclopentadien-1-yl]trichlorozirconium
  • (n-Butylcyclopentadienyl)zirconium trichloride
  • Zirconium, [(1,2,3,4,5-η)-1-butyl-2,4-cyclopentadien-1-yl]trichloro-
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