Polymer-Functionalized Silica via RAFT Linker Covalent Bonding

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Solution Overview

Problem

Current silica-silane technology in rubber compounds for tires faces challenges such as limited surface modification of silica, energy and time consumption, emissions of volatile organic substances, and inability to independently adjust hardness and rebound elasticity effectively.

Innovation Solution

A process using reversible addition-fragmentation chain transfer (RAFT) polymerization to produce polymer-functionalized silica filler particles, where a RAFT agent and linker molecule form covalent bonds with the silica surface, allowing targeted control of polymer loading and interface properties.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Strength

If silane is bound to silica in the basic mixing stage (silanization), then chemical bonds are formed between silica and polymer, but the process requires high demands on mixing conditions (time, temperature) and cannot verify complete silane binding

Engineering Contradiction:
Improvechemical bond strength between silica and polymerVSAvoidmixing process complexity
Core Design Contradiction:
StrengthVSDevice complexity

Solution Approach 1:

The patent applies preliminary action by pre-modifying the silica surface with coupling reagents before the basic mixing stage. The silica particles are pre-treated with silane coupling agents under controlled conditions to ensure complete and uniform surface modification, then this pre-modified silica is added to the rubber compound. This eliminates the need for complex plateau mixing conditions during compounding while ensuring complete chemical bonding capability.

Inventive Principle:
Principle #10Preliminary action

2Strength

If silica-silane mixing process is used to strengthen interaction between polymer and filler, then adhesion is improved, but the process is energy and time consuming compared to carbon black mixing

Engineering Contradiction:
Improveadhesion between polymer and fillerVSAvoidenergy consumption of mixing process
Core Design Contradiction:
StrengthVSUse of energy by stationary object

Solution Approach 1:

The patent performs the energy-intensive silane modification of silica particles in advance, separate from the rubber compounding process. This pre-modification step is done under optimized conditions to ensure complete reaction, and the resulting pre-modified silica requires only standard mixing energy during compounding, comparable to carbon black processing.

Inventive Principle:
Principle #10Preliminary action

Solution Approach 2:

The patent uses silane coupling agents as intermediary substances that form chemical bridges between the silica surface and polymer matrix. These coupling agents contain both inorganic-binding groups (for silica) and organic-binding groups (for polymer), enabling strong adhesion without requiring excessive mixing energy to force mechanical interlocking.

Inventive Principle:
Principle #24Intermediary (Mediator)

3Reliability

If silica-silane technology is used to improve wet grip behavior, then wet grip is enhanced, but emissions of volatile organic substances (e.g. ethanol) occur during mixing

Engineering Contradiction:
Improvewet grip performanceVSAvoidemissions of volatile organic substances
Core Design Contradiction:
ReliabilityVSObject-generated harmful factors

Solution Approach 1:

The patent converts the harmful volatile organic emissions into a benefit by using water or alcohol-free silane modification processes. Instead of using traditional solvent-based silane treatments that emit VOCs, the patent employs water-based slurries or solvent-free melt modification methods, where the volatile component is eliminated or replaced with non-toxic water that can be easily removed by drying, maintaining the adhesion-promoting benefits without environmental harm.

Inventive Principle:
Principle #22Blessing in disguise (Convert harm into benefit)

4Adaptability or versatility

If targeted modification of silica surface is attempted during basic mixing, then surface properties can be adjusted, but complete verification of silane binding is not possible

Engineering Contradiction:
Improvesurface modification adjustabilityVSAvoidverification of silane binding
Core Design Contradiction:
Adaptability or versatilityVSMeasurement precision

Solution Approach 1:

The patent performs detailed surface modification and verification in advance, before the rubber compounding process. Pre-modified silica particles are characterized using techniques like FTIR spectroscopy, XPS, or TGA to confirm complete and uniform silane binding. This pre-verification eliminates the need for verification during mixing, and the standardized pre-modified particles can be used across different formulations, improving both adaptability and measurement precision.

Inventive Principle:
Principle #10Preliminary action

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 method improves the rubber mixture's hardness and rebound elasticity, particularly at high temperatures, enhancing rolling resistance and wet grip performance while reducing environmental impact.

Implementation Method 1

reversible addition-fragmentation chain transfer polymerization, RAFT

Methodology Applied
Scientific EffectRAFT polymerization: Chemical Bonding

Implementation Method 2

functionalizing the surface of the filler particles with at least one linker molecule that can form a covalent bond with the polymer or the RAFT agent

Methodology Applied
Scientific EffectCovalent bonding: Chemical Bonding

Data Source

PatentEP3885411A1Silica with modified surface
Publication Date: 2021.09.29 CONTINENTAL REIFEN DEUTSCHLAND GMBH
  • EP3885411A1 patent drawing
  • EP3885411A1 patent drawing
  • EP3885411A1 patent drawing

AI summary

The present invention relates to a process for producing polymer-functionalized filler particles, wherein the filler particles comprise or consist of silica, comprising the following process steps: a) performing a RAFT polymerization to obtain a polymer coupled to a RAFT agent, b) functionalizing the surface of the filler particles with at least one linker molecule capable of forming a covalent bond with the RAFT agent, and c) forming a covalent bond between the linker molecule bound to the surface of the filler particles and the polymer obtained in step a) in order to couple the polymer obtained in step a) to the surface of the filler particles via the linker molecule, the polymer-functionalized filler particles obtainable by this process, a rubber compound comprising these polymer-functionalized filler particles, and a tire comprising this rubber compound.