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Understanding the power of catalysis

Chia-Wei Hsu , Information Scientist | CAS

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The transformative role of catalysts and catalysis

From baking bread to making paper , humans have unknowingly been harnessing the power of catalysis for thousands of years. In fact, almost everything in your daily life has been produced through the process of catalysis. Catalysts are substances that facilitate chemical reactions by lowering the activation energy required for the reaction to occur. They increase the rate of the reaction without being consumed or permanently altered in the process. Their unique properties have made them indispensable in a myriad of vital real-world applications , from fuel and pesticides to the development of life-saving pharmaceuticals.

For example, one of the most prominent catalyst-enabled reactions, the "Haber-Bosch process”, produces ammonia for fertilizer and agriculture on an industrial scale. Using catalysts tremendously lowers the cost and accelerates the production of ammonia. Even now, the Harbor-Bosch process is the major production method of ammonia.

Another example is found in catalytic converters for cars which use platinum, palladium, or rhodium to reduce emissions of toxic compounds like hydrocarbons, carbon monoxide, and nitrogen oxides by 90%.

The role of catalysis in sustainable chemistry

Though sustainability may feel like a recent buzzword, sustainable environmental practices have been firmly on the agenda since the publication of the United Nation’s (UN’s) ‘Our Common Future’ in 1987. This groundbreaking report mapped out guiding principles for sustainable development as it is generally understood today, defining the concept as “development that meets the needs of the present without compromising the ability of future generations to meet their own needs.” This definition sums up the importance of implementing sustainability into all manufactured products.

The increasing emphasis on sustainability has sparked a transformative movement towards sustainable chemistry or 'green' chemistry , revolutionizing the way we design products and processes. This innovative approach seeks to enhance the efficiency of utilizing natural resources in chemical production. Three crucial avenues are pursued to achieve this goal: minimizing energy consumption, embracing environmentally friendly chemicals, and effectively managing material life cycles. Through these methods, sustainable chemistry is paving the way for a greener and more resource-efficient future.

Catalysts play a pivotal role in our pursuit of sustainable practices, offering a valuable tool to facilitate goals. They have contributed to the creation of biodegradable plastics, reducing our reliance on harmful materials. Furthermore, catalysts are instrumental in the production of fuels and fertilizers, optimizing efficiency and minimizing waste. Harnessing the power of catalysis empowers us to achieve remarkable feats in various fields while embracing sustainability as a guiding principle.

With surging demand for catalysts, there has been an increased call for environmentally friendly products to address issues with sustainable energy production, reduce industrial emissions, and tackle climate change. Using data from the CAS Content Collection™, we will explore the current research trends in sustainable catalyst research, highlighting key advances in this field.

Making catalysts more sustainable

Noble metals such as platinum, palladium, and iridium are widely used for their desired catalytic properties, such as high stability and temperature tolerance. They are also used to facilitate a wide array of chemical reactions, including Sonogashira coupling , Suzuki-Miyaura coupling , and Heck reaction .

However, the usefulness of noble metals is hindered by their high cost and limited availability. These precious metals are primarily obtained from large amounts of low-grade ores , requiring extensive mining efforts to extract even small quantities. This extraction process not only demands significant energy input but also poses potential environmental harm. Consequently, the utilization of noble metals in catalytic applications must be carefully weighed against the environmental impact and sustainability of such practices.

The limitations posed by the economic and environmental costs of noble metals, coupled with the growing global demand for catalysts, have spurred researchers to explore alternative options, particularly non-noble transition metals like titanium, iron, cobalt, and nickel. These metals offer several advantages over their noble counterparts. Firstly, they are more abundant, ensuring a sustainable supply for catalytic applications. Additionally, non-noble transition metals are more cost-effective, making them economically viable choices. Moreover, they exhibit low toxicity levels, reducing potential hazards in both production and application. Importantly, these metals are environmentally benign, minimizing adverse ecological impacts.

While non-noble metals present a promising alternative, it is important to acknowledge that they are not without their own challenges. Non-noble metals are often more reactive than noble metals; this reactivity may lead to the degradation of catalysts (reducing their durability) and to less selective catalytic activity (which leads to byproducts, generating wastes and reducing process efficiency). Moreover, the characterization of non-noble metals can be complex and demanding (Table 1).

Properties of noble metals and transition metals in catalysis
Table 1 — Properties of noble metals and transition metals in catalysis 

Nonetheless, the development of sustainable catalysts with non-noble metals is gaining traction. Insights from the CAS Content Collection reveal a large increase in publications for non-noble metal catalysts/catalysis between 2012–2022 (Figure 1).

General journal and patent publication trend of non-noble metal catalysts/catalysis between 2012–2022
Figure 1 — General journal and patent publication trend of non-noble metal catalysts/catalysis between 2012–2022

Technologies and advancements in catalysis

Over the past several decades, an array of specialized catalysts has been developed for essential real-world applications. These catalysts broadly fall into four sub-categories: electrocatalysts, photocatalysts, homogeneous catalysts, and biocatalysts (or enzymes).

Publication volume of each sub-field in journals and patents
Figure 2 — Publication volume of each sub-field in journals and patents

Data from the CAS Content Collection shows that electrocatalyst-related publications are dominant in sustainable chemistry using non-noble metal catalysts (Figure 2 and Figure 3). Electrocatalysts participate in electrochemical reactions either as electrodes or as catalytic materials applied onto electrode surfaces. Traditionally, platinum has been widely employed in electrocatalysis. However, its limited availability and high cost have prompted researchers to explore alternatives. One noteworthy example involves the use of nitrogen-doped graphene augmented with cobalt atoms , which has proven to be an efficient and durable catalyst for generating hydrogen from water. Approaches like this represent a significant step toward lower-cost catalysts for energy production.

Human intelligence-selected electrocatalyst-related concepts in journals (top) and patents (bottom)
Figure 3 — Human intelligence-selected electrocatalyst-related concepts in journals (top) and patents (bottom)

Photocatalysis is a process by which semiconductor materials absorb light energy and produce electron-hole pairs that drive reduction and oxidation reactions. It is important for solving energy and environmental problems in reactions such as water splitting to produce hydrogen and the decomposition of pollutants respectively (Figure 4). However, a major research challenge is finding non-noble metal semiconductor materials capable of splitting water using only solar energy. Several strategies are being explored in this area, including the use of co-catalysts or multi-component nanointegration .

Top 15 reaction concepts to which photocatalysts are applied
Figure 4 — Top 15 reaction concepts to which photocatalysts are applied

Noble metals such as platinum and palladium are also predominant in homogeneous catalysis due to their high activity, stability, and versatility. However, finding substitutes for noble metals in homogeneous catalysts presents a complex and ongoing challenge for researchers. A key reaction facilitated by these catalysts is Sukuzi coupling. Famously, reports where authors claimed to demonstrate palladium-free Suzuki coupling were later shown to be catalyzed by low levels of palladium contaminants. However, the use of radical reaction initiators like iodine, eosin, and tetrabutylammonium iodide holds promise in this area (Figure 5).

Top 15 substances mostly used as homogeneous catalysts
Figure 5 — Top 15 substances mostly used as homogeneous catalysts

Biocatalysts, which are catalysts based on enzymes, offer a remarkable example of green and sustainable catalysts. Produced from readily available renewable feedstocks, they are organic, biodegradable, non-toxic, and can function under mild reaction conditions. A key potential application of biocatalysts is in the sustainable generation of biofuels from vegetable oils and fats by the transesterification of fatty acids with methanol. The reaction produces biodiesel (fatty acid methyl esters) and glycerol as a byproduct (Figure 6). The combination of biocatalysts and metal catalysts is also an emerging approach to achieving the sustainability of valuable molecule production.

Biodiesel production via enzymic transesterification
Figure 6 — Biodiesel production via enzymic transesterification

A catalyst for change

In the wake of the UN Climate Change Conference (COP27) and the UN Biodiversity Conference (COP15), there has been a notable surge in corporate commitments to embrace more sustainable practices . As catalysts remain indispensable in the chemical industry, there is a growing impetus to explore novel catalytic concepts that can enhance the efficiency and sustainability of essential product manufacturing. Recognizing this need, the U.S. Department of Energy has made a dedicated commitment to support fundamental catalyst research.

The significant advancements in sustainable catalyst research in the past decade signify that the pursuit of environmentally friendly solutions is well underway. While the full potential of this market is yet to be realized, we anticipate a promising future for non-noble, metal-based catalysts across diverse domains encompassing organic, inorganic, and bio-based substances.

For further insights into the future of sustainable catalysis, we invite you to explore our recent publication in ChemRxV.

 

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Pharma data management: Revealing breakthroughs that lie in darkness

Jennifer Sexton , Director/CAS Custom Services

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Data-rich, information-poor: The reversible curse of the pharmaceutical industry

The pharmaceutical industry generates and retains abundant scientific and business information, from pre-clinical studies to sales. However, these documents are typically held in siloed sources and lead to substantial annual storage expenses, encompassing about 52% of a business’ storage budget .

Unaware of this dark data or how to maximize its potential, companies inevitably fall into the “data-rich, information-poor” or “DRIP” situation . This concept describes organizations with significant amounts of data but no processes to produce valuable information and gain a competitive advantage.

Thanks to the rise of digitalization, companies can implement advanced organizational tools that help them stop generating dark data and effectively transform currently latent information into evidence-based insights. However, cleaning, organizing, and exploiting massive data can become overwhelming. Engaging with an outside data expert offers a tailored, step-by-step approach to pharmaceutical companies ready to bring their knowledge management system to the next level.

Digitize and harmonize: Bringing structure to the dark data chaos

Pharma companies can retrieve and use dark data to direct R&D investment, optimize formulations, identify production bottlenecks, and assess quality systems and controls. However, the Nature article “Scientists losing data at a rapid rate” estimated that about 80% of scientific data becomes unavailable in 20 years or less, making proper information retrieval perilous.

Building up in binders, drawers, and unsecured virtual platforms, dark data can take many forms which are often disconnected. As years go by and teams evolve, a company’s knowledge can quickly become scattered and hard to retrieve. By digitizing your legacy documents and collecting all the information in a single knowledge management platform, you can increase data retrieval efficiency, reduce resource allocation towards data management tasks, and improve experience sharing within your organization.

A clear benefit is demonstrated through the launch of Pistoia Alliance Chemical Safety Library , which facilitates information sharing between scientists to improve laboratory safety.

Expertise can help digitize and harmonize data
Transforming latent data into searchable and exploitable assets requires expertise to perform proper document digitization, reliable quality checks, and safe integration into your company’s ecosystem. A good outside partner understands and masters every component to help create a unique data collection tailored to your need.

From abandoned drug development to market successes, your company’s past overflows with valuable lessons. By structuring and harmonizing this dark data, a data partner can help you transform latent information into evidence-based insights with endless opportunities for innovation.

Benefits of a data management partnership:

  • Properly digitized physical documents, including scientific articles, reports, lab journals, images, and videos into digital formats.
  • Harmonized digital content with consistent terminologies, abbreviations, and formats.
  • Confirmed data quality, accuracy, and integrity to ensure robust foundations for your knowledge management platform.
  • Custom designed search tools to improve data accessibility and retrieval.
  • Ensured long-term data maintenance and management by implementing tailored acquisition strategies.

Analyze and optimize: Finding patterns and opportunities in your data

Dusting off dark data and structuring your knowledge management platform can greatly extend your company’s value. By analyzing massive datasets, companies can identify previously unseen trends. Uncovering patterns in previous discovery R&D, formulation data, or manufacturing methods can significantly save time, improve processes across your value chain, and support critical business decisions.

A digital transformation effort of Mana.bio highlights how pharma companies can optimize the success of their unique internal platforms, databases, and workflows through the integration of quality curated data and technology. Through this initiative, Mana.bio updated its proprietary database to fuel its drug delivery AI engine, with an expected 70% reduction in resources allocated to molecular data acquisition and preparation.

As your knowledge management platform grows in accuracy and value, your team can confidently identify trends and start working toward their next discovery. Uncovering patterns becomes easier, quicker, and more rewarding.

How an outside partner can help pharma improve data analysis and insight generation
An outside partner will be an expert at designing comprehensive, fully-functional data platforms to offer companies a complete view of their data landscape. By teaming up with a data expert, pharmaceutical businesses can:

  • Establish a data foundation for analytics and insights with strong frameworks and data integrity.
  • Identify knowledge gaps and project opportunities to fill them.
  • Get support with data visualization and analytics to uncover patterns and trends.
  • Expand and supplement their internal data with additional content.

Connect and Innovate: Get the right information to the right people

Pharma companies gather many bright and knowledgeable individuals dedicated to revolutionizing healthcare. However, communication among the company's experts is often disjointed, jeopardizing growth opportunities and affecting innovation progress. In the era of digitalization, reports show that companies could increase workers' productivity 20 to 25% by using social technologies like data management.

From R&D, operations, and quality management to IT, marketing, and finances, departments must work hand-in-hand to provide patients with the best pharmaceuticals. Through a company-wide knowledge management system, you can provide your teams with a secure workspace to efficiently share data, past experiences, and best practices.

A cloud-based platform brings real-time collaboration to the next level, allowing researchers, engineers, and technical experts to search and retrieve information quickly, giving your teams the data accessibility and collaborative environment they need to make business-changing decisions faster.

How an outside data partner can help pharma companies connect and innovate
By partnering with an expert in high-level knowledge management systems, pharmaceutical leaders can:

  • Create a shared cloud-based knowledge management platform that is company-wide and suitable for all their teams.
  • Ensure data safety and minimize breaches by enforcing user access control and limiting third-party software use.
  • Facilitate secure exchanges of confidential or sensitive information through secure channels.
  • Promote interdisciplinary brainstorming and collaboration to multiply avant-garde visions and accelerate innovation.

Knowledge management and dark data: Essentials of the pharmaceutical innovators

While long considered “nice-to-have” in the pharma industry, a robust and secure knowledge management system now represents an essential breeding ground for innovative and collaborative work. Structured and harmonized in a company-wide interface, formerly unworkable dark data can quickly change into valuable insights for industrials seeking growth opportunities.

As digitalization continues gaining ground, leveraging dark data and cognitive tools in the pharma industry becomes necessary to stay on top of innovation in the drug development sector.

To learn more about digital transformation and data management, check out our case studies with CAS Custom Services. 

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