Ether Isocyanates Intrinsic Catalysis Reaction Rate

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Solution Overview

Problem

Aliphatic isocyanates have a significantly lower reaction rate compared to aromatic isocyanates, requiring catalysis or higher temperatures for reactions, which is often disadvantageous.

Innovation Solution

The use of special open-chain, possibly branched, ether isocyanates with 2 or 3 carbon atoms between NCO groups and ether oxygen atoms, which are intrinsically catalyzed, allowing for faster and more efficient reactions with other reactants such as alcohols, amines, and CO2, reducing the need for additional catalysts.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Ease of manufacture

If aliphatic isocyanates are used, then lower cost and easier handling are achieved, but reaction rate is significantly reduced

Engineering Contradiction:
Improveease of handlingVSAvoidreaction rate
Core Design Contradiction:
Ease of manufactureVSSpeed

Solution Approach 1:

The patent modifies the molecular structure of aliphatic isocyanates by introducing ether oxygen atoms at specific positions (2 or 3 carbon atoms between NCO group and ether oxygen), which changes the chemical parameters of the molecule to enhance its intrinsic reactivity without requiring external catalysts

Inventive Principle:
Principle #35Parameter changes

Solution Approach 2:

The ether isocyanates possess intrinsic catalytic activity within their own molecular structure, allowing them to catalyze their own polymerization and reaction processes without requiring external catalysts, thus achieving self-service functionality

Inventive Principle:
Principle #25Self-service

2Speed

If catalysts are used to increase reaction rate, then reaction rate is improved, but process complexity and cost increase

Engineering Contradiction:
Improvereaction rateVSAvoidprocess complexity
Core Design Contradiction:
SpeedVSDevice complexity

Solution Approach 1:

The ether isocyanates contain intrinsic catalytic groups within their molecular structure that enable them to catalyze their own polymerization reactions, eliminating the need for separate catalyst addition and simplifying the process

Inventive Principle:
Principle #25Self-service

Solution Approach 2:

The catalytic function is merged into the molecular structure of the isocyanate itself rather than being a separate additive, combining the reactant and catalyst functions into a single substance

Inventive Principle:
Principle #5Merging (Combining)

3Speed

If higher temperatures are used to increase reaction rate, then reaction rate is improved, but energy consumption and side reactions increase

Engineering Contradiction:
Improvereaction rateVSAvoidenergy consumption
Core Design Contradiction:
SpeedVSUse of energy by moving object

Solution Approach 1:

The patent changes the molecular parameters of aliphatic isocyanates by introducing ether oxygen atoms, which fundamentally alters the activation energy requirements and enables reactions to proceed at lower temperatures with higher rates

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 enables the production of high-quality, reactive polyisocyanates with improved reaction rates and reduced catalyst requirements, producing a range of polyurethane plastics and coatings with enhanced properties.

Implementation Method 1

ether isocyanates... are 'intrinsically' catalyzed

Methodology Applied
Scientific EffectIntrinsic catalysis: Catalysis

Data Source

PatentEP3878914A1Use of specific open-chain ether isocyanates
Publication Date: 2021.09.15 COVESTRO DEUTSCHLAND AG
  • EP3878914A1 patent drawing
  • EP3878914A1 patent drawing

AI summary

The invention relates to the use of at least one open-chain, optionally branched, ether isocyanate with an NCO functionality ≥ 1, in which two or three carbon atoms are located between at least one NCO group and at least one ether oxygen atom, optionally in the presence of further reactants such as alcohols, amines, water, CO2, or further isocyanates with an NCO functionality ≥ 1, optionally in the presence of at least one catalyst, to increase the reaction rate and/or reduce the amount of catalyst optionally required in the isocyanate modification. The invention also relates to a two-component system and the molded parts, coatings, and composite parts obtainable therefrom.