Transition Metal Catalyst with Dative Oxygen Bonds

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Solution Overview

Problem

There is a need for new and improved catalyst systems for olefin polymerization to achieve specific polymer properties such as low molecular weights, increased conversion, or altered comonomer distribution without compromising the polymer's properties.

Innovation Solution

Development of novel transition metal catalyst compounds with specific oxygen atom bonding configurations and bridging groups, combined with activators, to enhance olefin polymerization processes.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Productivity

If conventional catalyst systems are used for olefin polymerization, then polymerization can proceed, but the molecular weight control and comonomer incorporation are insufficient

Engineering Contradiction:
Improvepolymerization efficiencyVSAvoidmolecular weight control
Core Design Contradiction:
ProductivityVSManufacturing precision

Solution Approach 1:

The patent applies local quality by creating asymmetric ligand environments around the metal center through specific oxygen atom bonding configurations and bridging groups. This localized structural differentiation enables precise control over polymer chain growth, achieving both high productivity and controlled molecular weight through the differentiated local chemical environment at the catalyst active site

Inventive Principle:
Principle #3Local quality

Solution Approach 2:

The patent utilizes parameter changes by modifying the electronic and steric parameters of the catalyst through specific oxygen bonding modes (dative bonds) and bridging group selections. These parameter modifications to the catalyst structure enable tuning of polymerization kinetics and polymer properties, resolving the contradiction between productivity and molecular weight control

Inventive Principle:
Principle #35Parameter changes

2Productivity

If conventional catalyst systems are used, then polymerization occurs, but comonomer distribution and incorporation are not optimized

Engineering Contradiction:
Improveconversion rateVSAvoidcomonomer distribution
Core Design Contradiction:
ProductivityVSStability of the object's composition

Solution Approach 1:

The patent applies local quality by creating specific local chemical environments through oxygen bonding configurations and bridging groups that favor selective comonomer incorporation. This localized structural control enables differentiated interaction with monomer and comonomer species, achieving optimized comonomer distribution while maintaining high conversion rates

Inventive Principle:
Principle #3Local quality

Solution Approach 2:

The patent uses the oxygen atoms and bridging groups as intermediaries that mediate between the metal center and incoming monomers/comonomers. These intermediary ligands control the electronic and steric environment, facilitating selective comonomer incorporation and stable composition control during high-rate polymerization

Inventive Principle:
Principle #24Intermediary (Mediator)

3Manufacturing precision

If new catalyst structures are developed to improve polymer properties, then molecular weight control improves, but catalyst complexity increases

Engineering Contradiction:
Improvemolecular weight controlVSAvoidcatalyst structure complexity
Core Design Contradiction:
Manufacturing precisionVSDevice complexity

Solution Approach 1:

The patent applies segmentation by dividing the catalyst structure into distinct functional modules: the metal center, oxygen bonding units, and bridging groups. This segmented architecture allows independent optimization of each component for molecular weight control while managing overall complexity through modular design principles

Inventive Principle:
Principle #1Segmentation

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 catalyst systems achieve improved molecular weights and comonomer incorporation, maintaining polymer properties and efficiency in polymerization processes.

Implementation Method 1

two of the oxygen groups are bonded to the metal by dative bonds

Methodology Applied
Scientific EffectDative bonding: Chemical Bonding

Implementation Method 2

catalyst systems comprising such, and polymerization processes using such

Methodology Applied
Scientific EffectCatalysis: Catalysis

Data Source

PatentUS10280234B2Catalyst compositions and use thereof
Publication Date: 2019.05.07 EXXONMOBIL CHEMICAL PATENTS INC
  • US10280234B2 patent drawing
  • US10280234B2 patent drawing
  • US10280234B2 patent drawing

AI summary

This invention relates to novel transition metal catalyst compounds comprising four oxygen atoms bonded to a transition metal where two of the oxygen groups are bonded to the metal by dative bonds and a silyl or germyl bridge, catalyst systems comprising such, and polymerization processes using such.