Ligand Compound for Olefin Oligomerization Selectivity

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Solution Overview

Problem

Existing methods for producing 1-hexene and 1-octene through ethylene oligomerization face challenges in achieving high selectivity and catalytic activity, leading to increased production costs due to high comonomer costs and varying market demands.

Innovation Solution

A novel ligand compound with a diphosphinoamine group structure, incorporating bulky alkyl and aryl groups, is used in a catalyst system comprising a transition metal source and cocatalyst to control the electronic and steric environment around the metal center, enhancing selectivity and catalytic activity for olefin oligomerization.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Manufacturing precision

If existing ligand compounds are used for ethylene oligomerization, then catalytic activity can be maintained, but selectivity for specific olefins (1-hexene or 1-octene) is insufficient

Engineering Contradiction:
Improveselectivity for 1-hexene or 1-octeneVSAvoidcatalytic activity
Core Design Contradiction:
Manufacturing precisionVSProductivity

Solution Approach 1:

The patent introduces ligands with specific local structural features - bulky substituents at ortho positions of phenyl rings and heteroatom-containing groups at meta positions. These localized structural modifications create specific electronic and steric environments at the metal center, enabling both high selectivity for 1-hexene/1-octene and maintained catalytic activity

Inventive Principle:
Principle #3Local quality

Solution Approach 2:

The patent systematically varies ligand parameters including substituent types (alkyl, aryl, heteroatom-containing groups), substituent positions (ortho, meta), and steric bulk. These parameter changes in ligand structure directly influence the electronic and steric properties of the catalyst, achieving optimal balance between selectivity and activity

Inventive Principle:
Principle #35Parameter changes

2Stability of the object's composition

If comonomer content in LLDPE is increased to control density, then polymer properties are improved, but production cost increases due to high comonomer cost

Engineering Contradiction:
Improvedensity control of polyethyleneVSAvoidcomonomer cost
Core Design Contradiction:
Stability of the object's compositionVSQuantity of substance

Solution Approach 1:

The patent enables selective production of specific alpha-olefin comonomers (1-hexene or 1-octene) through selective ethylene oligomerization using the developed catalyst system. This self-service approach allows producers to manufacture their own comonomers with high selectivity, reducing dependency on external suppliers and lowering overall production costs

Inventive Principle:
Principle #25Self-service

3Adaptability or versatility

If selective ethylene oligomerization is used to produce specific alpha-olefins, then market demand alignment is improved, but production cost increases due to complex catalyst requirements

Engineering Contradiction:
Improveability to produce specific olefin typesVSAvoidcatalyst system complexity
Core Design Contradiction:
Adaptability or versatilityVSDevice complexity

Solution Approach 1:

The patent develops a universal chromium catalyst system that can selectively produce different alpha-olefins (1-hexene or 1-octene) by simply changing the ligand structure. This multi-functional catalyst system eliminates the need for multiple specialized catalysts, reducing overall system complexity while maintaining versatility

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

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 system achieves higher catalytic activity and selectivity for 1-hexene and 1-octene production, reducing by-product formation and improving the efficiency of olefin oligomerization compared to existing systems.

Implementation Method 1

a catalyst system for olefin oligomerization, comprising the ligand compound; a source of transition metal; and a cocatalyst

Methodology Applied
Scientific EffectCatalysis: Catalysis

Data Source

PatentEP2987797B1Ligand compound, catalyst system for oligomerizing olefin, and method for oligomerizing olefin using same
Publication Date: 2018.10.17 LG CHEM LTD
  • EP2987797B1 patent drawing
  • EP2987797B1 patent drawing
  • EP2987797B1 patent drawing

AI summary

This disclosure relates to a ligand compound, a catalyst system for olefin oligomerization, and a method for olefin oligomerization using the same. The catalyst system for olefin oligomerization according to the present invention has excellent catalytic activity, and yet, exhibits high selectivity to 1-hexene or 1-octene, thus enabling more efficient preparation of alpha-olefin.