Dehydrochlorination Process for 1,1,3-Trichloropropene

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Solution Overview

Problem

Current processes for producing chlorinated alkenes, such as 1,1,3-trichloropropene, face challenges due to the formation of unwanted impurities, which affect catalyst performance and yield, and are not economically viable, especially when using alkaline hydroxides, leading to unacceptable impurity profiles and difficulties in downstream processes.

Innovation Solution

A process involving the dehydrochlorination of 1,1,1,3-tetrachloropropane to produce 1,1,3-trichloropropene, where the molar ratio of 1,1,3-trichloropropene to 1,1,1,3-tetrachloropropane is controlled between 5:95 to 30:70, and the reaction is conducted at 120°C to 170°C with a catalyst, ensuring high purity and minimizing the formation of problematic impurities and improving catalyst activity.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Productivity

If the dehydrochlorination reaction is allowed to proceed to high conversion, then the yield of 1,1,3-trichloropropene increases, but the formation of unwanted impurities increases and catalyst performance deteriorates

Engineering Contradiction:
Improveyield of 1,1,3-trichloropropeneVSAvoidformation of unwanted impurities
Core Design Contradiction:
ProductivityVSObject-generated harmful factors

Solution Approach 1:

The patent applies dynamic control of reaction conditions by continuously adjusting the residence time and conversion level in the dehydrochlorination reactor. The process maintains optimal conversion levels (controlling molar ratio between 5:95 to 30:70) rather than allowing complete conversion, thereby dynamically balancing product yield with impurity formation and catalyst preservation throughout the continuous operation.

Inventive Principle:
Principle #15Dynamics

Solution Approach 2:

The patent changes key reaction parameters including temperature (120°C to 170°C), pressure, and most importantly the molar ratio of 1,1,3-trichloropropene to 1,1,1,3-tetrachloropropane (controlled between 5:95 to 30:70). These parameter adjustments optimize the dehydrochlorination reaction to maximize yield while minimizing unwanted impurities and maintaining catalyst activity.

Inventive Principle:
Principle #35Parameter changes

2Ease of manufacture

If traditional alkaline hydroxides are used in the dehydrochlorination process, then the reaction can proceed, but the impurity profile becomes unacceptable and downstream processing becomes difficult

Engineering Contradiction:
Improvefeasibility of dehydrochlorination reactionVSAvoidpurity of 1,1,3-trichloropropene
Core Design Contradiction:
Ease of manufactureVSManufacturing precision

Solution Approach 1:

The patent introduces a solid acid catalyst as an intermediary substance to facilitate the dehydrochlorination reaction instead of using traditional alkaline hydroxides. This catalyst mediator enables the reaction to proceed while producing a much cleaner impurity profile that is easier to manage in downstream processing, thereby resolving the contradiction between reaction feasibility and product purity.

Inventive Principle:
Principle #24Intermediary (Mediator)

Solution Approach 2:

The patent fundamentally changes the chemical nature of the reaction medium by replacing alkaline hydroxides with solid acid catalysts operating under controlled temperature (120°C to 170°C) and pressure conditions. This parameter change in the reaction system transforms the impurity profile from unacceptable to commercially viable, maintaining ease of manufacture while achieving high manufacturing precision.

Inventive Principle:
Principle #35Parameter changes

3Productivity

If the reaction temperature is increased to improve reaction rate, then productivity increases, but the formation of side products and impurities increases

Engineering Contradiction:
Improvereaction rate of dehydrochlorinationVSAvoidformation of side products
Core Design Contradiction:
ProductivityVSObject-generated harmful factors

Solution Approach 1:

The patent optimizes the temperature parameter within a specific range (120°C to 170°C) to achieve the desired balance between reaction rate and selectivity. This controlled temperature parameter change ensures sufficient productivity through adequate reaction kinetics while preventing excessive thermal energy input that would lead to unwanted side reactions and impurity formation.

Inventive Principle:
Principle #35Parameter changes

Solution Approach 2:

The solid acid catalyst acts as an intermediary that lowers the activation energy barrier, enabling the dehydrochlorination reaction to proceed at moderate temperatures (120°C to 170°C) with high reaction rates. This catalyst mediation eliminates the need for high temperatures that would otherwise be required to achieve acceptable productivity, thereby preventing thermal side reactions and impurity formation.

Inventive Principle:
Principle #24Intermediary (Mediator)

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 results in a highly selective and efficient production of 1,1,3-trichloropropene with reduced impurities, enhancing catalyst performance and yield, and allows for the production of high-purity chlorinated alkenes without the use of alkaline hydroxides, making the process economically viable and suitable for industrial-scale operations.

Implementation Method 1

contacting 1,1,1,3-tetrachloropropane, with a catalyst in a dehydrochlorination zone to produce a liquid reaction mixture comprising 1,1,1,3-tetrachloropropane and 1,1,3-trichloropropene

Methodology Applied
Scientific EffectCatalysis: Catalysis

Implementation Method 2

extracting 1,1,3-trichloropropene from the reaction mixture

Methodology Applied
Scientific EffectLiquid-Liquid Extraction: Liquid-Liquid Extraction

Data Source

PatentEP3207012B1Process for preparing 1,1,3-trichloropropene by controlling the molar ratio of 1,1,3-trichloropropene to 1,1,1,3-tetrachloropropane
Publication Date: 2021.06.30 SPOLEK PRO CHEMICKOU A HUTNI VYROBU
  • EP3207012B1 patent drawingFigure 1
  • EP3207012B1 patent drawingFigure 2
  • EP3207012B1 patent drawingFigure 3

AI summary

Disclosed is a process for preparing a chlorinated alkene, comprising contacting a chlorinated alkane with a catalyst in a dehydrochlorination zone to produce a liquid reaction mixture comprising the chlorinated alkane and the chlorinated alkene, and extracting chlorinated alkene from the reaction mixture, wherein the concentration of the chlorinated alkene in the reaction mixture present in the dehydrochlorination zone is controlled such that the molar ratio of chlorinated alkene : chlorinated alkane is from 1 :99 to 50:50.