1-Pentyl-3-Methylimidazolium Thiocyanate: Description, Properties, and Use

What is 1-Pentyl-3-Methylimidazolium Thiocyanate?

1-Pentyl-3-Methylimidazolium Thiocyanate belongs to a group of chemicals called ionic liquids, which have opened up new possibilities for chemists and engineers in different fields. The substance combines a pentyl-functionalized imidazolium cation with a thiocyanate anion, creating a material that stands out for both its structure and set of physical properties. In contrast to water and common organic solvents, ionic liquids like this one often remain stable at room temperature, and sometimes even take on the appearance of a thick liquid or solid flakes, depending on purity, storage, and temperature.

Structure and Formula

This ionic liquid's molecular formula sits at C9H17N3S. Its structure pairs a five-carbon pentyl side chain and a one-carbon methyl group on the imidazolium ring, which influences how it behaves in chemical environments. The thiocyanate anion brings an element of nucleophilicity and coordination, known to be handy in certain organic syntheses. Under a trained eye, the substance can alternate between crystalline forms in cooler settings and thicker, more viscous liquids when warmed. Its varied form – flakes, powder, pearls, solid, or even, after absorption of moisture, as a liquid – demands careful handling and storage.

Physical Properties

Lab experience suggests a specific gravity between 1.10 and 1.14 g/cm³ at ambient conditions, though density can shift slightly with batch or storage. The appearance usually falls between off-white pearls and semi-transparent crystalline material. In some test runs, the powder shows a greasy feel, hinting at its ionic nature. Viscosity can catch the unwary; in solution, it resists pouring with a thickness much greater than water or most alcohols. Melting points typically range from 35°C to 45°C, but this can change with contamination or improper sealing. It shows thermal stability well above the boiling point of water, not starting to decompose until about 250°C or more, which is why it attracts attention as a safer replacement for volatile organic solvents.

Material Handling and Raw Material Safety

Inside the lab, 1-Pentyl-3-Methylimidazolium Thiocyanate does not emit strong odors or fumes under room conditions, and unlike some liquids in this category, it doesn't tend to irritate the skin on brief contact. Still, the thiocyanate ion is known for being harmful if swallowed in quantity, affecting the thyroid in animal tests, which means gloves and lab coats remain standard. Good ventilation avoids build-up of any decomposed fumes during heating. While the imidazolium component by itself isn't especially reactive, mixing with strong acids or bases may trigger hazardous releases of HCN or other toxic substances, demanding close monitoring in these types of syntheses. The bulk material travels in tightly sealed containers, often as pearls or refined crystalline solid, and as with all synthetic chemicals, accidental exposure or environmental release gets reported to workplace safety authorities straight away.

Specification and HS Code

For customs and shipping, 1-Pentyl-3-Methylimidazolium Thiocyanate usually travels under HS Code 292529, which covers imidazole derivatives. Specifications on lab-grade or industrial batches depend on water content, with top-range batches reaching purities above 99.0%. Moisture content stays under 0.5% for most uses; mathematics and experiments involving sensitive reactions push for drier material. Trace heavy metals rarely show up, but a spec sheet can reassure buyers about lead, arsenic, and mercury levels falling below international guidelines. In quality assurance routines, melting point confirms identity, and NMR or HPLC provide detailed fingerprinting to flush out unexpected byproducts. Most suppliers offer densities, melting range, and solubility upon request, since these factors can tip the scale in chemical manufacturing or research.

Molecular and Chemical Properties

The surface tension and high polarity of 1-Pentyl-3-Methylimidazolium Thiocyanate mean that in mixing trials with water or common alcohols, the extent of miscibility changes depending on both temperature and ionic strength. The thiocyanate anion, being a “soft” ligand, provides moderate nucleophilicity and coordinates with metals—making this ionic liquid a functional choice for transition metal extractions or catalytic cycles. It resists oxidation by atmospheric oxygen much better than many common ionic solvents, giving it better shelf life when stored away from strong acids. Solubility in non-polar solvents drops off quickly; it prefers polar, protic, or even some aprotic environments, confirming its niche utility in chemical labs.

Safe Usage and Harmful Properties

Full personal experience using this chemical tells a clear story: while 1-Pentyl-3-Methylimidazolium Thiocyanate rates as a safer alternative to many traditional solvents, respect for its harmful possibilities cannot waver. Swallowing, inhalation of powders, or prolonged skin absorption may cause toxicity owing to its anionic component. Studies link thiocyanate to health issues over repeated or high-dose exposure, including thyroid impacts. The cation portion avoids serious biological targets but adds to the need for safe disposal and spill response. Practicing chemists keep their standards high: closed handling, cold storage, and disposal by certified chemical waste firms keep risks under control, especially in larger industrial settings.

Applications and Solutions

In the world of ionic materials, 1-Pentyl-3-Methylimidazolium Thiocyanate finds active roles in electrochemistry, organic synthesis, and physical property research. Labs swap out flammable, volatile organics for this substance in certain reactions or as a safer carrier in analytical routines. Researchers use it for its designable properties—tuning the cation or switching out the anion shapes the outcome in mixing, solubility, and reactivity. Problems arise around the cost, supply chain reliability, and the environmental load of manufacturing both the cation and anion starting materials. Greener production could shift away from petroleum-based raw materials and closer to biobased or low-impact processes. Regulation grows year by year; the spread of specific disposal and reporting requirements will push this industry to tighten practices and minimize risks to handlers and the environment. Researchers and suppliers need to keep current with both academic and government work, pushing the chemical world a little safer and a little further every day.