Tactic Polymer Synthesis via Chiral Catalyst Asymmetry

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Solution Overview

Problem

Existing processes for preparing tactic polymers, especially multi-block copolymers, face challenges such as reduced tacticity, crystallinity, and molecular weight due to the use of racemic mixtures of enantiomers, leading to inferior polymer properties like heat resistance and block length.

Innovation Solution

A process involving a non-racemic mixture of R- and S-enantiomers of a metal complex catalyst, combined with a chain shuttling agent, in the presence of a polar aprotic solvent, to polymerize olefin monomers, resulting in high molecular weight, defect-free, and highly crystalline multi-block copolymers.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Manufacturing precision

If a racemic mixture of enantiomers is used as catalyst, then polymer production can proceed, but tacticity and crystallinity are reduced due to inversions in the polymer chain

Engineering Contradiction:
ImprovetacticityVSAvoidinversions in polymer chain
Core Design Contradiction:
Manufacturing precisionVSObject-generated harmful factors

Solution Approach 1:

The patent applies asymmetry by using a non-racemic mixture of enantiomers (preferably enriched with one enantiomer such as the R-enantiomer) instead of a racemic mixture. This asymmetric catalyst composition reduces the frequency of inversions in the polymer chain, thereby improving tacticity and crystallinity while maintaining productive polymerization.

Inventive Principle:
Principle #4Asymmetry

2Adaptability or versatility

If multiple catalysts with differing comonomer incorporation properties are used, then multi-block copolymers can be formed, but block length and molecular weight are reduced

Engineering Contradiction:
Improvemulti-block copolymer formationVSAvoidblock length
Core Design Contradiction:
Adaptability or versatilityVSLength of moving object

Solution Approach 1:

The patent applies parameter changes by optimizing the ratio of catalysts (e.g., Catalyst A:Catalyst B in a ratio of 1:4 to 4:1), the amount of chain shuttling agent (0.01-10 equivalents relative to total catalyst), and reaction conditions to achieve both multi-block copolymer formation and increased block length/molecular weight.

Inventive Principle:
Principle #35Parameter changes

3Productivity

If chain shuttling agents are used under continuous solution polymerization conditions, then productivity is improved, but polymer properties such as heat resistance and crystallinity decrease

Engineering Contradiction:
Improvecontinuous solution polymerization efficiencyVSAvoidheat resistance
Core Design Contradiction:
ProductivityVSReliability

Solution Approach 1:

The patent applies parameter changes by using a non-racemic mixture of enantiomeric catalysts in continuous solution polymerization, which maintains high productivity while improving heat resistance and crystallinity by reducing chain inversions and improving tacticity.

Inventive Principle:
Principle #35Parameter changes

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

This approach enhances polymer crystallinity, modulus, and heat resistance, while increasing block length and reducing defects, thereby improving the overall properties of the tactic polymers.

Implementation Method 1

polymerizing one or more olefin monomers in the presence of a chain shuttling agent and a catalyst composition comprising a chiral catalyst

Methodology Applied
Scientific EffectCatalysis: Catalysis

Implementation Method 2

employing multiple catalysts and a compound known as a 'chain shuttling agent' (CSA)

Methodology Applied
Scientific EffectChain shuttling:

Implementation Method 3

A process involving a non-racemic mixture of R- and S-enantiomers of a metal complex catalyst, combined with a chain shuttling agent, in the presence of a polar aprotic solvent

Methodology Applied
Scientific EffectSolvation: Solvation

Data Source

PatentUS8148482B2Tactic polymer polymerization process using chiral catalysts
Publication Date: 2012.04.03 DOW GLOBAL TECHNOLOGIES LLC
  • US8148482B2 patent drawing
  • US8148482B2 patent drawing
  • US8148482B2 patent drawing

AI summary

A process for forming tactic polymers employing at least one olefin polymerization catalyst comprising a non-racemic mixture of the R- and S-enantiomers of a metal complex containing at least one asymmetrically substituted (chiral) carbon atom, and a chain shuttling agent, a polar aprotic organic compound, or both a chain shuttling agent and a polar aprotic organic compound.