Metallocene Catalyst System for Controlled Comonomer Distribution

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Solution Overview

Problem

Current metallocene catalyst systems for olefin polymerization face challenges in achieving specific polymer properties such as high melting point, high molecular weights, and controlled comonomer distribution, often requiring multiple catalysts and complex processes.

Innovation Solution

A catalyst system comprising a metallocene compound represented by specific formulas, activated with a Group 4 transition metal, a bridging group, and a cyclopentadienyl ring, which allows for the production of ethylene copolymers with tailored melting temperatures and comonomer distribution when contacted with olefins and activators.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Adaptability or versatility

If traditional activators are used to activate metallocene catalysts, then the catalyst can perform olefin polymerization, but the catalyst cannot effectively control comonomer incorporation or manipulate its activity towards specific monomers

Engineering Contradiction:
Improvecatalyst activity controlVSAvoidcatalyst system complexity
Core Design Contradiction:
Adaptability or versatilityVSEase of manufacture

Solution Approach 1:

The patent introduces a boron-based activator compound as an intermediary that mediates between the metallocene catalyst and the olefin monomers. This activator, with its specific structure containing a non-coordinating anion and a counter-cation, enables the catalyst to achieve both high activity and controlled comonomer incorporation without requiring complex multi-component systems

Inventive Principle:
Principle #24Intermediary (Mediator)

2Manufacturing precision

If chain shuttling polymerization with two catalysts is used, then comonomer distribution can be controlled, but the process complexity increases significantly

Engineering Contradiction:
Improvecomonomer distribution controlVSAvoidcatalyst system complexity
Core Design Contradiction:
Manufacturing precisionVSDevice complexity

Solution Approach 1:

The patent creates a universal single catalyst system that performs multiple functions: it activates the metallocene for polymerization, controls comonomer incorporation, and regulates catalyst activity. This multi-functional activator eliminates the need for multiple catalysts and chain shuttling agents, simplifying the process while maintaining precision in comonomer distribution

Inventive Principle:
Principle #6Universality (Multi-functionality)

3Reliability

If multiple catalysts are used to achieve specific polymer properties, then polymer properties can be optimized, but the number of process steps and components increases

Engineering Contradiction:
Improvepolymer property consistencyVSAvoidprocess efficiency
Core Design Contradiction:
ReliabilityVSProductivity

Solution Approach 1:

The patent merges the functions of multiple catalysts into a single integrated catalyst system. The metallocene compound combined with the boron-based activator creates a unified system that delivers consistent polymer properties (high melting point, controlled molecular weight, regulated comonomer distribution) while improving process efficiency by reducing the number of components and steps required

Inventive Principle:
Principle #5Merging (Combining)

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 system produces ethylene copolymers with elevated melting points and controlled comonomer distribution, enhancing polymer properties and simplifying the polymerization process by using a single catalyst system.

Implementation Method 1

a catalyst system comprising a metallocene compound represented by specific formulas, activated with a Group 4 transition metal

Methodology Applied
Scientific EffectCatalysis: Catalysis

Data Source

PatentUS9611348B2Process of producing polyolefins using metallocene polymerization catalysts and copolymers therefrom
Publication Date: 2017.04.04 EXXONMOBIL CHEMICAL PATENTS INC
  • US9611348B2 patent drawing
  • US9611348B2 patent drawing
  • US9611348B2 patent drawing

AI summary

An ethylene copolymer, a Group 4 transition metal catalyst compound, and methods for polymerization using such a compound, said compound represented by the formula: (L)p(R′)zT(Cp)(A)MX2, where M is a Group 4 metal; z is 0 to 8; p is 1 to 3; X is an anionic leaving group; T is a bridging group; R1 to R4 are hydrogen, a hydrocarbyl group, a substituted hydrocarbyl group, aryl group, substituted aryl group, or a heteroatom-containing group (where adjacent R groups can form rings); R′ is hydrogen, a C1 to C10 alkyl group, a C6 to C24 aryl group, or a C7 to C40 alkylaryl group; and L is a heteroatom or heteroatom-containing group bound to T, Cp is a cyclopentadienyl ring substituted with 0 to 4 substituent groups (where adjacent groups can form C4 to C20 rings); A is Cp or (JS′z*-1-y), where J is a Group 15 or 16 element; S′ is a hydrocarbyl, substituted hydrocarbyl, or heteroatom; z* is 2 or 3, and y is 0 or 1, is provided.