Ejector Mixing for Isocyanate Synthesis Selectivity

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Solution Overview

Problem

Existing processes for preparing isocyanates by reacting amines with phosgene in the gas phase face challenges such as high temperatures leading to immediate reaction, formation of unwanted by-products like ureas, and decomposition of amines due to elevated evaporation temperatures, which reduce selectivity and cause plant blockages.

Innovation Solution

A process involving an ejector where phosgene is passed through a central nozzle and amine through an annular gap, creating a mixing zone with phosgene at sonic velocity, followed by a diffuser that increases temperature and pressure, allowing for rapid mixing at lower temperatures and pressures, thereby reducing by-product formation and enhancing selectivity.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Manufacturing precision

If the amine is evaporated at elevated temperature to achieve gas phase reaction, then the reaction selectivity is improved, but the amine undergoes decomposition reactions such as deaminations, demethylations, and dimerizations

Engineering Contradiction:
Improvereaction selectivityVSAvoidamine decomposition
Core Design Contradiction:
Manufacturing precisionVSLoss of substance

Solution Approach 1:

The amine is pre-evaporated and preheated to reaction temperature before mixing with phosgene. This preliminary action ensures the amine is in the gas phase and at the optimal temperature for the phosgenation reaction, improving reaction selectivity while controlling decomposition through precise temperature management in the preheating zone

Inventive Principle:
Principle #10Preliminary action

Solution Approach 2:

The reaction mixture is rapidly mixed and quickly passed through the reactor at high velocity. This rushing through approach minimizes the residence time at elevated temperatures, thereby reducing the extent of decomposition reactions while maintaining high reaction selectivity for isocyanate formation

Inventive Principle:
Principle #21Skipping (Rushing through)

2Manufacturing precision

If the reactant streams are mixed rapidly to avoid secondary reactions, then the formation of by-products is reduced, but mixing conditions that accelerate secondary component formation may still occur

Engineering Contradiction:
Improveprocess selectivityVSAvoidby-product formation
Core Design Contradiction:
Manufacturing precisionVSObject-generated harmful factors

Solution Approach 1:

The mixing process is segmented into distinct zones: a preheating zone where reactants are separately heated, a mixing zone where rapid mixing occurs, and a reaction zone where the phosgenation reaction proceeds. This segmentation allows rapid mixing to be achieved while controlling the conditions to minimize secondary reactions and by-product formation

Inventive Principle:
Principle #1Segmentation

Solution Approach 2:

Different local conditions are created in different zones of the reactor. The preheating zone has elevated temperature for vaporization, the mixing zone has rapid turbulence for homogeneous mixing, and the reaction zone has controlled temperature and residence time. This local quality approach enables rapid mixing while minimizing by-products through zone-specific optimization

Inventive Principle:
Principle #3Local quality

3Productivity

If high temperature is used for evaporation and reaction, then the reaction rate is increased, but unwanted side reactions and amine decomposition occur

Engineering Contradiction:
Improvereaction rateVSAvoidamine decomposition
Core Design Contradiction:
ProductivityVSLoss of substance

Solution Approach 1:

The temperature parameter is dynamically changed throughout the process: reactants are preheated to high temperature for rapid vaporization, then the mixed reaction mixture is quickly cooled or maintained at controlled temperature during the short residence time in the reactor. This parameter change approach maintains high reaction rate while minimizing decomposition

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 preparation of isocyanates with reduced by-product formation, particularly ureas, and extends plant run time by controlling reaction conditions to optimize selectivity and minimize amine decomposition.

Implementation Method 1

the reactants emerge from the component in the form of thin free jets, where they then mix very rapidly as a result of diffusion and/or turbulence

Methodology Applied
Scientific EffectDiffusion: Diffusion

Implementation Method 2

the reactants emerge from the component in the form of thin free jets, where they then mix very rapidly as a result of diffusion and/or turbulence

Methodology Applied
Scientific EffectTurbulence: Turbulence

Implementation Method 3

a diffuser in which pressure and temperature of the reaction mixture composed of phosgene and amine are increased

Methodology Applied
Scientific EffectAdiabatic heating: Adiabatic Heating

Data Source

PatentUS8765996B2Process for preparing isocyanates
Publication Date: 2014.07.01 BASF SE
  • US8765996B2 patent drawing
  • US8765996B2 patent drawing

AI summary

The invention relates to a process for preparing isocyanates by reacting the corresponding amines with phosgene in the gas phase, if appropriate in the presence of at least one inert medium, the phosgene being passed into a reactor (21) through a first inlet and the amine through a second inlet of an ejector (1). The first inlet and the second inlet open into a mixing zone (17) in which the phosgene and the amine are mixed to give a reaction mixture. The mixing zone (17) is followed downstream by a diffuser (19) in which pressure and temperature of the reaction mixture composed of phosgene and amine are increased.