MSDS for N-Butylimidazolium Trifluoromethanesulfonate

Identification

Product Name: N-Butylimidazolium Trifluoromethanesulfonate
Chemical Formula: C8H15F3N2O3S
CAS Number: 174899-66-2
Synonyms: 1-Butyl-3-methylimidazolium triflate, [BMIM][OTf], Butylimidazolium triflate
Recommended Use: Solvent, Electrolyte, Ionic liquid in research and industrial chemistry
Supplier Information: Common distributors include Sigma-Aldrich, Alfa Aesar
Emergency Contact: Refer to company-specific details, local Poison Control Center

Hazard Identification

GHS Classification: Not classed as a hazardous substance under most global regulations, but caution needed due to limited toxicity data
Signal Word: Warning
Hazard Statements: May cause mild skin and eye irritation, precautions recommended for inhalation or ingestion, avoid dust formation, higher concentrations may harm aquatic environments
Pictograms: Exclamation mark for irritation
Precautionary Statements: Do not breathe dust or vapor, wash skin after handling, wear protective gloves, avoid release to environment

Composition / Information on Ingredients

Chemical Name: N-Butylimidazolium Trifluoromethanesulfonate
Concentration: 100% (neat substance)
CAS Number: 174899-66-2
Impurities: No significant impurities expected based on commercial synthesis routes
Molecular Weight: 294.28 g/mol

First Aid Measures

General Advice: Move exposed individuals away from dust or spillage
Inhalation: Remove to fresh air, offer respiratory support if symptoms develop, seek medical help if irritation or coughing persists
Skin Contact: Remove contaminated clothing, wash skin with soap and plenty of water, seek advice if irritation remains
Eye Contact: Rinse immediately with plenty of water for at least fifteen minutes, lift eyelids, call eye doctor if pain continues
Ingestion: Rinse mouth with water, do not induce vomiting, drink water if able, consult poison information or doctor

Fire-Fighting Measures

Suitable Extinguishing Media: Use water spray, foam, dry chemical, or carbon dioxide
Special Hazards: Burns may release toxic fumes including nitrogen oxides, sulfur oxides, hydrogen fluoride
Fire-Fighter Protection: Use self-contained breathing apparatus, wear protective clothing, avoid inhaling combustion gases
Fire Behavior: Substance does not burn easily but can support burning in presence of organic material

Accidental Release Measures

Personal Precautions: Wear gloves, goggles, suitable protective clothing, ensure adequate ventilation, avoid breathing vapors
Evacuation: Keep unnecessary personnel away from spill site
Containment: Prevent run-off into drains, rivers, or sewers; cover spillage with inert absorbent material like sand
Cleanup: Sweep up, collect for disposal, wash area with soapy water, ventilate affected zone
Environmental Precautions: Block spillage from reaching surface water, report large releases to local authority

Handling and Storage

Safe Handling: Avoid contact with skin and eyes, do not eat, drink, or smoke in work area, wash hands thoroughly after use, avoid high temperatures and static discharge
Storage Conditions: Store in tightly closed container, dry, well-ventilated place, keep away from heat and incompatible materials like oxidizing agents
Incompatibilities: Strong oxidizing agents, strong acids
Special Advice: Regularly check containers for leaks

Exposure Controls and Personal Protection

Exposure Limits: No official occupational exposure limits available
Engineering Controls: Work in chemical hood or ensure good air exchange, handle in closed systems if possible
Personal Protective Equipment: Safety goggles, chemical-resistant gloves (nitrile or neoprene recommended), lab coat or apron, use respiratory protection for dust or vapor formation
Hygiene: Wash hands and face after handling, do not reuse contaminated PPE
Environmental Controls: Measures in place to avoid spillage and environmental contamination

Physical and Chemical Properties

Appearance: Clear to pale yellow liquid (can solidify at low temperatures)
Odor: Faint, not distinctive
pH: Neutral to mildly acidic (no significant pH in water due to low solubility)
Melting Point/Freezing Point: -3 °C (approximate, varies by purity)
Boiling Point: Decomposes above 250 °C
Flash Point: >150 °C
Evaporation Rate: Non-volatile
Solubility: Slightly soluble in water, highly soluble in polar organic solvents
Density: Approximately 1.3–1.4 g/cm³
Viscosity: Moderate, higher than water
Vapor Pressure: Negligible at ambient temperature

Stability and Reactivity

Chemical Stability: Stable at ambient temperature and normal storage conditions
Hazardous Reactions: Violent reaction possible with strong oxidizers
Hazardous Decomposition: May produce nitrogen oxides, hydrogen fluoride, sulfur oxides, toxic organic fragments upon thermal decomposition
Conditions to Avoid: Strong heat, contact with strong acids or oxidizers, static discharge
Incompatibility: Alkalis, oxides, certain metals in fine powder form

Toxicological Information

Likely Routes of Exposure: Skin contact, eye contact, inhalation, accidental ingestion
Acute Toxicity: No data for oral, dermal, or inhalation LD50 in humans, animal studies show moderate toxicity at very high doses
Irritation: Can irritate skin and eyes
Chronic Effects: Long-term effects not well studied, repeated exposure may irritate mucous membranes
Sensitization: Not reported under current data
Carcinogenicity: No evidence from studies or regulatory listings
Reproductive Toxicity: No data available
Other Effects: Not known to cause allergic reactions or systemic toxicity under regular use

Ecological Information

Aquatic Toxicity: Moderately toxic to aquatic life if released in large amounts, can persist and accumulate
Persistence and Degradability: Poorly biodegradable under standard conditions
Mobility in Soil: Moderate due to ionic nature, some risk of leaching
Bioaccumulation: Not expected to bioaccumulate substantially, but chronic impact not fully studied
Other Adverse Effects: Prevent entry to surface waters or drains, long environmental half-life possible

Disposal Considerations

Waste Treatment Methods: Treat as hazardous chemical waste, handle according to local, state, national guidelines
Containers: Empty residues and packaging classified as hazardous, collect and store for disposal
Incineration: Preferred method with proper off-gas scrubbers, avoid disposal in landfill,
Sewer Disposal: Not suitable due to persistence and aquatic toxicity concerns
Disposal Personnel Protection: Wear gloves, goggles, and use proper containment, avoid spillages during transport

Transport Information

UN Number: Not regulated under UN Recommendations for Transport of Dangerous Goods
Proper Shipping Name: N-Butylimidazolium trifluoromethanesulfonate
Hazard Class: Not classified under IMDG, IATA, DOT, ADR as dangerous
Packing Group: Not assigned
Transport Instructions: Package tightly, secure against leaks, avoid exposure to heat or incompatible substances during transit, document transport with MSDS in vehicle

Regulatory Information

US Regulations: Not specifically listed by OSHA, SARA Title III, CERCLA or TSCA inventory
EU Regulations: Not classified as dangerous under CLP Regulation, does not appear in Annex XIV (REACH)
Canada: DSL/NDSL status varies by supplier, check for up-to-date listing
Other Local Regulations: Handle and report based on country-specific chemical handling codes
Labeling Requirements: Ensure container labels include product identification, hazard pictograms for laboratory and workplace safety
Restriction on Use: Intended for professional and research applications only, not for use in consumer products