2-Phenyl-1,3-Propanediol: An In-Depth Look

Historical Development

Organic chemistry always throws up these small molecules with big stories. 2-Phenyl-1,3-propanediol stands as one of those quietly versatile compounds that found a place in labs and industries over decades. Synthetic efforts began in the first half of the 20th century, following curiosity from early dye and pharmaceutical industries seeking functional diols. Early chemists leaned on straightforward condensation and reduction approaches due to limited technology, producing small batches for both structural studies and fledgling drug syntheses. Studies in the 1960s and 70s, particularly tied to pharmaceutical analogs, saw the compound receive attention for its stability and ease of chemical modification. Its gentle entry set a foundation for further advancements in aryl alkyl diol chemistry, linking old-school bench chemistry to today’s more automated, scalable operations.

Product Overview

Far from a household name, 2-Phenyl-1,3-propanediol serves as a building block behind the scenes in research and manufacturing. Its value lies in its bifunctional alcohol groups and phenyl ring, making it a key intermediate for creating pharmaceuticals, fine chemicals, and specialty polymers. The structure gives researchers options for selective transformation and has ensured it remains a staple in those hunting for benzyl-protected skeletons or scaffoldings to build up more complex molecules. This core diol shape sets the stage for a wealth of modifications, which explain its regular appearance in patents and synthetic schemes.

Physical & Chemical Properties

In pure form, 2-Phenyl-1,3-propanediol typically appears as a white crystalline solid with a slight aromatic scent, a nod to its phenyl group. Melting points usually clock in around 73-77°C, with boiling points above 285°C at standard pressure, offering a decent thermal window for most lab uses. The molecule dissolves well in common polar organics—think ethanol, acetone, and even chloroform—while resisting water more stubbornly due to the hydrophobic ring. Reactivity revolves around its primary and secondary –OH functionalities. Both are handy for forming esters, ethers, or acting as nucleophiles, and the phenyl ring tolerates mild electrophilic aromatic substitutions if you want to play around with further modification.

Technical Specifications & Labeling

Quality matters, especially in research and production. Purity specs for 2-Phenyl-1,3-propanediol depend on intended use. Analytical and synthetic chemists usually demand at least 98% purity, keeping impurities like benzyl alcohol or 1,3-propanediol itself below 1% by weight. Labels should clearly state the chemical name, common synonyms, molecular formula (C9H12O2), molar mass (152.19 g/mol), lot number, and detailed handling instructions, including hazard warnings. Batch-specific spectra (like NMR or GC-MS traces) often travel with shipments destined for pharmaceutical development to confirm structural integrity. Storage instructions generally recommend cool, dry conditions, tightly sealed from the open air to prevent any accidental oxidation or moisture uptake.

Preparation Method

The most well-trod route for synthesizing this diol begins with benzaldehyde and malonic acid or its esters. The Knoevenagel condensation produces the intermediate, which is then hydrogenated, usually over palladium on carbon, to produce 2-Phenyl-1,3-propanediol with good yields. Other methods lean on Grignard reactions, using phenyl magnesium bromide with oxirane or derivatives, though chemists wrestle with regioselectivity unless they use protecting strategies. Over the years, sustainable process tweaks—like using water or ethanol as greener solvents, or flow reactors for safer hydrogenation—have reduced both waste and operational hazards for makers keen to scale up for commercial use.

Chemical Reactions & Modifications

With its solid chemical backbone, this diol adapts to a variety of transformations. Both alcohol groups react cleanly with acid chlorides or anhydrides, forming esters prized in scent and flavor chemistry and as intermediates for drugs. Ethers emerge from Williamson syntheses, courtesy of alkyl halides and base. Dehydration routines can cyclize the molecule under acid catalysis, pushing the field toward new ring systems and heterocycles, especially if there are neighboring group effects at play. Oxidation selectively yields aldehydes or ketones, each offering a new angle for medicinal chemists seeking analogs for activity screens. The benzene ring opens the door for electrophilic additions if a catalyst, like FeCl3, is used. Its diol skeleton even tempers more aggressive reactions, resisting unwanted side-products in multistep routes.

Synonyms & Product Names

Anyone digging through chemical catalogs will find 2-Phenyl-1,3-propanediol listed by a handful of synonyms: β-Phenyl-1,3-propanediol, 1,3-Dihydroxy-2-phenylpropane, or phenyltrimethylene glycol. Some databases tag it under short forms, especially in pharmaceutical and cosmetic ingredient listings. Popular suppliers use varied names—Sigma-Aldrich calls it out as 2-Phenyl-1,3-propanediol, while TCI, Alfa Aesar, and others might capitalize on the older β-Phenyl naming tradition. This chemical identity flexibility underscores the need for careful label reading in multidisciplinary labs where slip-ups over synonyms occasionally disrupt workflow.

Safety & Operational Standards

Safety is king, especially for handling fine chemicals. MSDS fact sheets for 2-Phenyl-1,3-propanediol note low acute toxicity and only mild irritation on skin or eye contact. Still, gloves and goggles stay standard. In lab-scale synthesis, most exposures happen through spills or dust, so ventilation and local exhaust matter, especially during drying or transfer. Combustion produces toxic fumes like carbon monoxide, and the solid can form fine dusts if mishandled, so proper dust control helps prevent accidental ignition. Waste disposal needs alignment with regional chemical laws, usually via sealed solvent drums or solid hazardous waste bins. Years of practice show that clear labeling, regular audits, and quick access to spill kits keep the work safe and smooth.

Application Area

This compound never screams headlines but quietly appears in diverse roles. It’s a favorite in pharmaceutical intermediate work, where modified derivatives appear in antihistamines and sedatives. Flavor and fragrance developers like the structural compatibility of the diol for propping up esters carrying subtle fruity or floral notes; its backbone accepts a range of acyl groups that broaden the palette. In materials science, researchers use the diol to introduce flexibility or altered solubility in specialty polymers or resins, often chasing improved performance at high temperatures or in harsh chemical environments. Analytical chemists sometimes use it as an internal standard in chromatography, thanks to its stability and ease of detection. That invisible versatility lets the diol bridge biology, chemistry, and engineering without much fuss.

Research & Development

R&D labs continue exploring modifications of the 2-Phenyl-1,3-propanediol scaffold for new bioactive molecules. Structure-activity relationship studies guide teams tweaking each site—switching out hydrogens for halogens or alkyl chains or cyclizing fragments to adjust pharmacodynamics. The backbone serves as a launchpad for experimental drugs, chiral synthons, and catalysts. Green chemistry circles pay close attention too, searching for better methods of production, lower waste, or routes that avoid rare metals. Computational chemists use the molecule as a benchmark rabbit hole for modeling hydrogen bonding, solvation, or aromatic stacking, given its well-defined structure and reliable behavior in both experiments and simulations.

Toxicity Research

Toxicologists have spent years mapping out the hazards of 2-Phenyl-1,3-propanediol. Oral LD50 numbers in rodents hover high relative to many organic compounds, suggesting low acute toxicity in the milligram-to-gram per kilogram range. Long-term studies point to minimal bioaccumulation, and metabolic profiling shows that mammals quickly process and excrete it through predictable oxidation pathways. Still, as with most small organics, the story changes if exposure is chronic or the compound is heavily inhaled as powder. Skin sensitization appears low, and irritation only occurs at high concentrations. Data on aquatic toxicity indicate low impact, though waste management rules recommend not dumping significant amounts into wastewater systems. Regulatory agencies currently score it low on the hazard scale, but ongoing vigilance guides its inclusion in new drugs or materials.

Future Prospects

The next chapters for 2-Phenyl-1,3-propanediol may unfold in green chemistry and tailored medicine. Its accessible backbone and ready reactivity make it a go-to scaffold for new pharmaceuticals, especially antivirals or central nervous system agents where functional group tweaks drive therapeutic profiles. With sustainability in focus, newer syntheses focus on bio-based feedstock, milder reagents, and closed-loop processes. In materials, the diol may spur the next crop of adaptable resins and biodegradable plastics, supporting eco-friendly tech and safer consumer goods. Artificial intelligence applications in molecular design may speed up the generation of new derivatives, helping the old diol keep pace with modern challenges. Whether as a staple in old-school synthesis or a springboard for future breakthroughs, 2-Phenyl-1,3-propanediol looks set to stick around in labs and factories alike for years to come.



What is 2-PHEVYL-1,3-PROPANEDIOL used for?

What This Compound Brings to the Table

Lab folks and industrial chemists probably spot 2-Phenyl-1,3-propanediol on their supplies list every so often. This organic molecule shows up with two alcohol groups on a three-carbon backbone and a phenyl group hanging on the first carbon—so, it’s got some flexibility for chemical builders. People aren’t hunting it down at the local hardware store, but its role in modern chemistry stands out. This molecule appears in synthetic projects that turn raw materials into specialized end products.

Home in Polymer Development

Polyester resins rely on diols, and this is one that steps up in research and specialty manufacturing. The structure lets it offer physical strength and temperature resilience to the final plastic. Imagine tough coatings or engineered plastics made for electronics—manufacturers count on building blocks that last. Chucking in 2-Phenyl-1,3-propanediol brings an aromatic ring into play, so end products can hold up better against heat or breakage.

Mixing new monomers into the tool chest helps teams meet strict rules for safety, shelf-life, and handling. The continued push for lighter, stronger gear means even small tweaks like this one make a difference. A clear example comes in coatings that protect car parts or touchscreen displays. The search for non-yellowing surfaces or scuff resistance often brings in specialized molecules like this one.

Connection to Pharmaceuticals

This compound pops up in several drug synthesis routes. Pharmaceutical chemists bank on molecules that add backbone stability or improve how well a drug dissolves. The diol group can anchor on to other ingredients or tweak biological activity, so it isn’t a stretch to say discoveries here might ripple into the next generation of medicines.

Take chiral synthesis as one example—2-Phenyl-1,3-propanediol sits at a position where it helps create pure chemical “handedness.” In the drug world, getting the right hand (enantiomer) can mean all the difference between a life-saving treatment and something harmful. This compound works as a steppingstone, bringing chemists closer to targeted therapy with fewer side effects.

Modern Research and Sustainability

Green chemistry keeps climbing the list of business priorities. Chemists are asked to limit waste, avoid harsh conditions, and choose the safest materials. 2-Phenyl-1,3-propanediol fits into projects focused on new, more sustainable processes. Because of its simple structure, it can be made using less energy or greener starting ingredients. Some teams have explored fermentation or catalytic methods to cut out the nastier parts of large-scale chemical production.

It’s easy for outsiders to picture chemicals as single-use or stuck in one field, but reality’s a lot messier. The same ingredient can spark innovation in plastics, pop up as a lifesaver in medicine, and help build a safer, smarter chemical industry. Keeping an eye on versatility like this—while pushing for cleaner production—sets the stage for more breakthroughs ahead.

Future Possibilities and WatchPoints

I remember visiting a materials science lab crowded with beakers, glassware, and off-the-wall ideas scribbled on whiteboards. Someone held up a sample with 2-Phenyl-1,3-propanediol as a key part in their polymer chain, pointing out how it changed everything from thermal stability to how easily the product could break down at end of life. This kind of work reminds me innovation doesn’t always need headline-grabbing discoveries; often, progress sneaks up through tweaks, substitutions, and small additions. Still, scrutiny matters—chemists should handle even common ingredients with care, watch their sourcing, and make sure end products land safely for everyone down the road.

What are the storage conditions for 2-PHEVYL-1,3-PROPANEDIOL?

Understanding a Sensitive Chemical’s Needs

Chemicals like 2-phenyl-1,3-propanediol don’t just wait quietly for the next experiment. With a track record in pharmaceutical research and chemical synthesis, this compound needs some respect on the storage front. Years of lab experience taught me that putting a bottle in the wrong spot can change everything—quality, safety, and even whether you still have usable material next week. You won’t find any shortcuts in chemical storage if you want results you can trust.

Temperature—The Deciding Factor

The truth is, chemical compounds with a phenyl group and multiple hydroxyls rarely stay stable on a sunny bench. Exposing 2-phenyl-1,3-propanediol to direct light or excessive heat might trigger degradation, impact purity, or, in some cases, spoil the substance entirely. Ideally, laboratories keep the temperature low, often between 2°C and 8°C, which lines up with general practice for sensitive organics. Pushing it even a few degrees higher could mean more byproducts and less controllable chemistry. I learned this lesson after losing an entire batch of phenyl alcohols to a faulty refrigerator—it cost us valuable synthesis time and a chunk of the project budget.

Light, Air, and Moisture—Invisible Saboteurs

Leaving compounds like 2-phenyl-1,3-propanediol exposed to light might sound harmless to folks outside the field. The reality? UV exposure can kick off unwanted reactions. Amber glass bottles serve as the go-to for a reason—they shield from UV rays, preventing breakdown and contamination. Keeping containers sealed cuts down the risk of moisture soaking in or, worse, mold taking hold. Water absorption changes the diol’s behavior and can ruin reproducibility in research. In my own lab, we used silica gel sachets in chemical cabinets as a simple insurance policy against moisture from summer humidity.

Contamination—The Unseen Threat

Pipetting right from the stock container or reusing gloves coated with another compound can introduce foreign substances faster than you think. Cross-contamination skews data and threatens safety. That’s why each batch gets its own, clean container, and nobody skips labeling. We once had an undergrad mix up diols—hours down the drain, and the cleanup tested everyone’s patience. Detailed labeling with purchase date, lot number, and hazard warnings keeps the confusion at bay and satisfies audit trails if the regulator shows up.

Putting Safety and Compliance First

Safety data sheets detail hazard profiles, and it pays to take them seriously. GHS labels, flame-proof storage if flammable, and chemical-resistant gloves aren’t paperwork for paperwork’s sake. They’re the result of real lab incidents and injury statistics. In regulated spaces, missing these basics can shut down operations or trigger fines. A secure, well-ventilated storage cabinet handles small spills or vapors before they escalate.

Practical Steps for Good Storage

A dry, dark, cool spot forms the foundation for storing 2-phenyl-1,3-propanediol. Glass containers with airtight seals fit the bill. Some labs invest in warnings connected to sensors, alerting staff if temperatures stray or moisture creeps in. Routine checks—inventory, labeling, equipment function—catch problems early. I’ve seen researchers skip these steps, only to regret it when compromised chemicals forced them to start over.

Building Long-Term Confidence in Research

Storage shapes not just today’s experiment, but tomorrow’s results. Treating 2-phenyl-1,3-propanediol with care leads to reproducible data, safer working spaces, and less waste. No matter the lab’s size, these habits guard against avoidable mistakes and keep projects moving forward. In the long run, a bit of diligence pays off in reliability and peace of mind.

Is 2-PHEVYL-1,3-PROPANEDIOL hazardous or toxic?

Why Chemical Safety Still Matters

Ask anyone who’s worked in a lab or in manufacturing about chemical safety, and you’ll see some real concern in their faces. People trust regulatory labels, but they want to know about things themselves. 2-Phenyl-1,3-propanediol (sometimes popping up in discussions around intermediates for drugs or specialty materials) has started to catch attention. Chemical names can sound intimidating, but behind all the data sheets, real people want to know about risks—and with good reason.

Digging Into the Hazards

Looking at the facts, there isn’t a mountain of published research focused just on this substance’s toxicity. The safety data sheets available from reputable suppliers provide some clue. Most sources describe it as low in acute toxicity for both skin contact and ingestion, with mild irritation possible. This isn’t the comfort blanket people crave, but it’s closer to a shrug than a panic button. Still, not every risk shows up in early paperwork. Chemicals once considered safe have landed on recall lists after people found respiratory or reproductive impacts years later.

ECHA, the European Chemicals Agency, mentions minimal concerns under normal handling, but there’s always the possibility of new findings. Most of what is known comes from occupational exposure. Factories might implement gloves, goggles, and good ventilation, not only out of habit, but because breathing in powders or liquids over years can build up trouble. Simple soap and water often resolve light spills on the skin, but direct eye contact should be treated with caution.

Context From Day-to-Day Exposure

Asking if something’s “toxic” skips over the details. Toxicity depends on dose, length of exposure, and individual health. Salt, water, and caffeine can damage organs or kill at high enough levels. From personal experience, seeing chemicals handled with care cuts down on the surprise factor. For lots of organic compounds, safe handling beats any label on a bottle. Most people working around 2-phenyl-1,3-propanediol in industry environments rely on proven precautions, not on the assumption of harmlessness. If something’s irritating at high concentrations, it pays to limit exposure—sometimes it’s enough to reduce dust or keep air moving in the room.

Supporting Evidence and Room for Improvement

Even with a “low hazard” tag from today’s experts, companies and universities rarely drop their guard. Reliable toxicology data keeps everyone honest. Anyone working in chemical development remembers how a lack of long-term studies on even simple substances led to policy changes. Right now, regulatory agencies stick to their role of monitoring and reviewing. Updates to chemical classification happen as soon as new data pops up, especially after epidemiological studies.

Better labeling and public access to safety data help, but more transparency around newer or less-common chemicals still lags. There’s a role for both industry and academia here—sharing practical experience and keeping large datasets open could allow databases like PubChem and ECHA to reflect reality more quickly.

Building Safer Work Habits

Nobody wants surprises in the workplace or in their daily life. Most health and safety lessons drilled into students apply far beyond the classroom. Wearing PPE, staying aware of air quality, and documenting near-misses form a real defense against the unknowns. While regulators evolve their guidance, daily vigilance stays the last line of protection.

What is the chemical structure of 2-PHEVYL-1,3-PROPANEDIOL?

Getting into the Details: What Does 2-Phenyl-1,3-Propanediol Look Like?

Something that has always made chemistry click for me is looking at a molecule as if I’m visualizing a Lego build. Each atom fits in a certain way, each bond gives shape to the whole. 2-Phenyl-1,3-propanediol gives a clear example. At its core, there’s a three-carbon backbone, with hydroxyl groups hooked onto the first and third carbon. The heart of the structure sits in the middle, but off that first carbon hangs a phenyl ring—the sort of hexagonal carbon ring you find in compounds like benzene. Written out, the formula looks like C9H12O2.

Breaking Down the Structural Elements

Every part gives 2-phenyl-1,3-propanediol its personality. The phenyl group offers chemical stability and a certain richness in how this molecule reacts. That trio of backbone carbons provides flexibility, while two hydroxyl groups add a dip at each end. The presence of these hydroxyls says that this molecule will show up as a diol—good at forming hydrogen bonds, potentially acting as an intermediate in both synthesis and breakdown.

Someone handling this molecule can spot the phenyl group as the aromatic ring, and these rings influence electron distribution and give molecules different scents, flavors, and even binding properties. The hydroxyl groups make this compound a bit sticky, able to interact with water, and open the door to oxidation or substitution reactions. That structure—basically a benzene ring on the corner of a propane chain holding two alcohol hooks—shows up in a surprising number of synthetic pathways.

Practical Impact and Why Shape Matters

I remember working on a research project where we tested phenyl-substituted diols as potential building blocks for economically-priced drug intermediates. 2-Phenyl-1,3-propanediol often gets considered in pharmaceuticals not just for its simple construction, but because that combination of phenyl and diol keeps the molecule flexible yet reactive. In some cases, this structure works as a scaffold for drugs designed to block specific enzymes. The shape fits in certain biological “locks” and delivers reliable interactions.

Pharmaceuticals aren’t the only spot where 2-phenyl-1,3-propanediol shows up. Lab chemists sometimes build on this framework to explore new approaches in organic synthesis. Those hydroxyl groups offer anchor points, where other chemical teams might strap on new elements, producing derivatives that tackle everything from polymer design to cosmetics.

Challenges, Safety, and Next Steps

Handling diols like this brings its own set of rules. Too many times, folks underestimate what a couple of hydroxyls can do—these groups encourage reactivity in both manufacturing and metabolism. A compound with this configuration can’t just be poured down the sink. Anyone using or producing it needs to pull on gloves, keep good ventilation, and follow established protocols, because that seemingly simple diol can react or degrade in unexpected ways.

Looking forward, researchers keep searching for ways to re-engineer basic building blocks like 2-phenyl-1,3-propanediol for greener syntheses. Swapping out harsh reagents, tuning temperature and pressure controls, and investing in safer storage all stem from truly understanding the structure. The more you learn to spot connections between shape, reactivity, and function, the more options you see for safe, sustainable, and economically sound solutions.

What is the purity or specification of the available 2-PHEVYL-1,3-PROPANEDIOL product?

Why Purity Matters in Practice

Every chemist knows a raw material’s quality can support a project or send it in a ditch. 2-Phenyl-1,3-propanediol shows up in all sorts of research—from synthesis of pharmaceuticals to organic chemistry studies. Purity isn’t just lab jargon. Get a batch that’s only 95%, and that leftover 5% could mean side reactions, wasted time, and questionable safety. If you’ve ever repeated a reaction only to get a new impurity peak in the chromatogram, you know how frustrating mystery ingredients can be.

Typical Commercial Specs

On the open market, you’ll spot 2-phenyl-1,3-propanediol with stated purities between 97% and 99%. Most suppliers back that up with a certificate of analysis, listing the main contaminants in trace amounts: leftover benzylic alcohols or sometimes a dash of benzaldehyde from incomplete reduction. A good lot usually carries no more than 0.2% water and less than 0.5% organic solvents—diethyl ether pops up sometimes if producers rush the isolation.

Real-World Lab Impact

In academic labs, I’ve seen researchers skip a cheap batch for a pricier 99.5% option, just to avoid column purification headaches. A few folks try “in-house” recrystallization, but for larger projects, that’s a time sink, especially when the raw stuff already meets high standards. In regulated pharma or flavor labs, no one gambles; labs demand proof with coupled chromatography and NMR. No spec sheet, no order. The cost for high-purity material is worth the labor it saves and the confidence it brings when submitting samples or publishing results.

Supply Chain Transparency Helps Everyone

Following new guidelines about supply chain traceability, some distributors have started sharing batch-level analytical data online. Spectra, chromatograms, and even impurity IDs offer reassurance and can save hours during method validation. That’s not industry standard yet, but it’s the easiest way to dodge supply headaches where a shipment batch’s profile quietly changes overnight. Researchers and quality teams push back, sharing bad experiences with warped data and supporting demand for consistency.

How Producers Can Raise the Bar

I’ve walked through mid-sized chemical plants, watched manual checks during drying, and seen the difference a filtration tweak can make on final purity. Simple steps—like using freshly distilled solvents or purging glassware before use—actually move purity up a notch. It doesn’t take high-powered innovation, just best practices and a culture of careful checking. Small changes in process design, such as low-temperature crystallization, help keep batches consistent from start to finish. Suppliers willing to keep that focus, and who don’t try to push older stock with variable analysis, earn loyalty.

Solutions for End-Users

Working with smaller suppliers? Ask for fresh certificates, look beyond the percent sign, and ask for details on known impurities. Run your check if the end use is sensitive—GC or HPLC data can catch most surprises. If budgets allow, bring in a high-grade sample, use it as a reference, and compare every new lot. Community-led review databases could also help spot trends or issues early, benefiting users across research and industry.

References

NIH PubChem: 2-Phenyl-1,3-PropanediolSigma-Aldrich Product Specifications

2-PHEVYL-1 3-PROPANEDIOL