Unsymmetrical Metallocene Catalysts for Polyethylene Wax

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Solution Overview

Problem

Current ansa-metallocene catalysts for polyolefin polymerization lack high polymerization activity and efficiency, particularly in producing linear high density polyethylene with narrow molecular weight distribution and good co-monomer incorporation, and are difficult to synthesize.

Innovation Solution

Development of unsymmetrical cyclopentadienyl-based ansa-metallocene compounds with specific structural formulas, immobilized on support materials like solid MAO, which enhance catalytic activity in producing polyethylene wax and copolymers with improved intermolecular uniformity.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Productivity

If conventional ansa-metallocene catalysts are used for polyolefin polymerization, then polymerization can proceed, but the polymerization activity and efficiency are insufficient

Engineering Contradiction:
Improvepolymerization activityVSAvoidcatalyst efficiency
Core Design Contradiction:
ProductivityVSReliability

Solution Approach 1:

The patent applies local quality by introducing specific substituent groups (R1-R4, Ra, Rb) at particular positions on the cyclopentadienyl rings of the metallocene catalyst. These localized modifications at specific sites create asymmetric electronic and steric environments around the metal center, which enhances polymerization activity and efficiency without requiring complete structural redesign of the entire catalyst molecule.

Inventive Principle:
Principle #3Local quality

Solution Approach 2:

The patent employs asymmetry by designing unsymmetrical substitution patterns on the cyclopentadienyl rings where substituents are placed at different positions and/or in different types on each ring. This asymmetric structure creates a chiral environment around the metal center that improves catalytic performance, polymerization activity, and produces polymers with controlled microstructure and narrow molecular weight distribution.

Inventive Principle:
Principle #4Asymmetry

2Manufacturing precision

If catalysts are designed to produce polyethylene with narrow molecular weight distribution and good co-monomer incorporation, then polymer quality improves, but catalyst synthesis complexity increases

Engineering Contradiction:
Improvemolecular weight distribution controlVSAvoidcatalyst synthesis complexity
Core Design Contradiction:
Manufacturing precisionVSDevice complexity

Solution Approach 1:

The patent applies preliminary action by pre-installing specific substituent groups (R1-R4, Ra, Rb) at defined positions on the cyclopentadienyl rings during catalyst synthesis. These pre-positioned groups create the necessary asymmetric electronic and steric environment before polymerization begins, enabling precise control over molecular weight distribution and co-monomer incorporation without requiring complex in-situ modifications during the polymerization process.

Inventive Principle:
Principle #10Preliminary action

Applied Scientific Principles

This section explains which scientific principles are used to turn an abstract innovation direction into a practical engineering solution.

Function Achieved in This Case

The new catalysts exhibit improved catalytic characteristics for producing polyethylene wax and copolymers with controlled molecular weights and uniform properties, addressing the limitations of existing catalysts in terms of activity and synthesis complexity.

Implementation Method 1

ethylene (and α-olefins in general) can be readily polymerized at low or medium pressures in the presence of certain transition metal catalysts

Methodology Applied
Scientific EffectCoordination chemistry:

Implementation Method 2

comprise an aluminoxane activator and a metallocene transition metal catalyst

Methodology Applied
Scientific EffectChemical activation:

Data Source

PatentUS11053269B2Unsymmetrical metallocene catalysts and uses thereof
Publication Date: 2021.07.06 SCG CHEM CO LTD
  • US11053269B2 patent drawing
  • US11053269B2 patent drawing
  • US11053269B2 patent drawing

AI summary

Unsymmetrical metallocene compounds based on cyclopentadienyl ligands are disclosed, as well as catalytic compositions comprising the compounds supported on solid support materials. The compounds and compositions are useful as catalysts in the polymerisation of olefins. In particular, the compounds and compositions are useful catalysts in the preparation of low molecular weight polyethylene (e.g. polyethylene wax) and copolymers formed from the polymerisation of ethylene and other α-olefins.