Material Safety Data Sheet: 1-Pentyl-3-Methylimidazolium Acetate

Identification

Product Name: 1-Pentyl-3-Methylimidazolium Acetate
CAS Number: 869295-64-3
Synonyms: [PMIM][Ac], 1-Pentyl-3-Methyl-Imidazolium Acetate
Recommended Use: Solvent, chemical synthesis, ionic liquid research
Manufacturer: Chemical supply companies specializing in ionic liquids
Emergency Phone: Local national chemical emergency hotline

Hazard Identification

GHS Classification: Acute Toxicity-Oral (Category 4), Skin Irritation (Category 2), Eye Irritation (Category 2A)
Signal Word: Warning
Hazard Statements: Harmful if swallowed, causes skin and eye irritation
Pictograms: Exclamation mark
Precautionary Statements: Avoid contact with eyes, skin, and clothing, wash thoroughly after handling, do not eat, drink, or smoke when using
Routes of Entry: Inhalation, skin absorption, ingestion
Potential Health Effects: Burning sensation, nausea, abdominal discomfort, redness or swelling at site of contact

Composition / Information on Ingredients

Chemical Name: 1-Pentyl-3-Methylimidazolium Acetate
Molecular Formula: C11H20N2O2
Molecular Weight: 212.29 g/mol
Concentration: 100%
Impurities and Stabilizing Additives: No known stabilizers; potential minimal residuals from synthesis

First Aid Measures

Inhalation: Remove exposed individual to fresh air, keep at rest, provide oxygen if breathing becomes difficult, seek medical attention for symptoms
Skin Contact: Remove contaminated clothing, rinse skin with plenty of water for at least 15 minutes, contact physician if irritation persists
Eye Contact: Rinse eyes cautiously with water for several minutes while holding eyelids open, remove contact lenses if present and easy to do, continue rinsing, consult medical personnel if irritation continues
Ingestion: Do not induce vomiting, rinse mouth with water, seek immediate medical attention, never give anything by mouth to an unconscious individual

Fire-Fighting Measures

Suitable Extinguishing Media: Dry chemical, CO2, foam, water spray
Specific Hazards: Possible release of toxic fumes including carbon oxides, nitrogen oxides, vapors from decomposition
Protective Equipment for Firefighters: Firefighters should wear self-contained breathing apparatus with full protective gear
Unusual Fire Hazards: Can form combustion products that irritate the respiratory system
Explosion Limits: Data not available, consider general precautions for ionic liquids
Auto-ignition Temperature: Not determined

Accidental Release Measures

Personal Precautions: Evacuate unnecessary personnel, wear appropriate protective equipment including gloves and splash goggles, ventilate area
Environmental Precautions: Prevent further leakage or spillage, avoid release into waterways or drains
Containment and Clean-Up Methods: Absorb with inert material such as sand or vermiculite, collect in suitable container for disposal, decontaminate area with soapy water, dispose of contaminated materials according to local regulations

Handling and Storage

Handling: Avoid contact with skin, eyes, and clothing, use only in well-ventilated areas or chemical fume hood, prevent formation of aerosol, keep away from flames and hot surfaces, practice good industrial hygiene
Storage: Store in tightly closed original container, keep in cool, dry, well-ventilated area, keep away from incompatible substances such as oxidizers and reducing agents, avoid moisture ingress to prevent hydrolysis or degradation, control temperature to avoid decomposition

Exposure Controls and Personal Protection

Engineering Controls: Work with local exhaust or comprehensive ventilation system, use process enclosures when feasible
Personal Protective Equipment (PPE): Chemical-resistant gloves (nitrile or neoprene preferred), laboratory coat or apron, safety goggles or face shield, use respiratory protection with organic vapor/acid gas cartridge for large scale manipulation or if ventilation is inadequate
Hygiene Measures: Wash hands before breaks, after handling, and after removing gloves, do not eat, drink, or smoke during use, remove contaminated clothing immediately and launder before reuse
Exposure Limits: No occupational exposure limits set for this material, use general dust and vapor limits as guideline (e.g., OSHA PEL for particulates not otherwise regulated)

Physical and Chemical Properties

Appearance: Colorless to pale yellow viscous liquid
Odor: Mild, possibly slight vinegar odor due to acetate group
Odor Threshold: Not determined
pH: Neutral to alkaline in water
Melting Point: Typically below room temperature
Boiling Point: Decomposes before boiling
Flash Point: Greater than 100°C, precise value depends on impurities
Evaporation Rate: Negligible
Flammability: Not highly flammable
Vapor Pressure: Very low at ambient conditions
Solubility: Miscible with water and many organic solvents
Partition Coefficient (n-octanol/water): Not determined
Vapor Density: Heavier than air
Relative Density: Approximately 1.08-1.10 g/cm³ at 20°C
Viscosity: Higher than water, increases with cold
Decomposition Temperature: Can decompose above 180°C, forming hazardous vapors

Stability and Reactivity

Chemical Stability: Stable under recommended storage conditions, sensitive to strong oxidizers
Possibility of Hazardous Reactions: Contact with strong acids, bases, or oxidizers may cause violent reactions or decomposition
Conditions to Avoid: Excess heat, moisture, contact with incompatible substances
Incompatible Materials: Strong acids, strong bases, oxidizing agents, reducing agents, materials reacting with carboxylates
Hazardous Decomposition Products: Carbon monoxide, carbon dioxide, nitrogen oxides, possible imidazole derivatives

Toxicological Information

Acute Toxicity: Oral LD50 (rat): Not specifically determined; ionic liquids of similar structure often fall in the 200-2000 mg/kg range
Skin Corrosion/Irritation: Causes irritation based on acetate anion irritancy and imidazolium cation effects
Serious Eye Damage/Irritation: Causes eye irritation, possible redness, pain, blurred vision
Respiratory or Skin Sensitization: No human data, related compounds can cause allergic reactions in sensitive persons
CMR Effects (Carcinogenicity, Mutagenicity, Reproductive Toxicity): No evidence from limited studies; insufficient animal or human data
Chronic Toxicity and Long-Term Effects: Not documented, ionic liquids have shown tissue irritancy in repeated exposure scenarios
Routes of Exposure: Ingestion, inhalation, dermal contact
Potential Symptoms: Nausea, headache, respiratory discomfort, skin rash, redness at contact area

Ecological Information

Ecotoxicity: Ionic liquids can be toxic to aquatic organisms, especially invertebrates, may exhibit moderate bioaccumulation potential
Persistence and Degradability: Slowly biodegradable; breakdown via hydrolysis and microbial metabolism in soil and water possible, but rate depends on environmental factors
Bioaccumulative Potential: Unlikely significant for this compound based on molecular size and water solubility, but data insufficient for firm conclusion
Mobility in Soil: May migrate in soil due to high water solubility, persistence increases risk of groundwater contamination
Other Adverse Effects: Not classified as environmentally hazardous, though precaution recommended until more field data collected

Disposal Considerations

Waste Treatment Methods: Dispose of product and contaminated containers in accordance with local, regional, and national regulations, avoid disposal into environment
Methods of Disposal: Incineration in a chemical incinerator equipped with afterburner and scrubber preferred method for sodium-containing ionic liquids; avoid dilution in public wastewater
Contaminated Packaging: Rinse with water, then dispose as hazardous waste
Special Precautions: Do not re-use empty containers, do not discharge into public sewage or on land uncontrolled

Transport Information

UN Number: Not regulated as a dangerous good for transport by road, sea, or air
UN Proper Shipping Name: Not regulated
Transport Hazard Class: Not classified
Packing Group: Not assigned
Environmental Hazards: Not defined as hazardous to aquatic environment under UN Model Regulations
Special Precautions: Package securely to prevent leaks; keep away from oxidizers and incompatible goods

Regulatory Information

TSCA Status: Not listed on US EPA TSCA Inventory, likely used for research or industrial applications
DSL/NDSL Status (Canada): Not listed
REACH Status (EU): Not registered, for use under scientific research and development, comply with EU regulations for laboratory use
Other Country Listings: Varies; check specific country chemical inventories for up-to-date information
OSHA Status: Not specifically regulated; general chemical safety provisions apply
SARA Title III (Hazard Categories): Not subject to reporting
WHMIS (Canada): Classified as hazardous product for acute toxicity/skin and eye irritation
Other Regulations: Observe all local, state, national, and international guidelines, keep records of use, handling, and disposal as required by law