Material Safety Data Sheet: 1-Allyl-3-Octylimidazolium Bromide

Identification

Product Name: 1-Allyl-3-Octylimidazolium Bromide
Chemical Formula: C16H29BrN2
Synonyms: AOIB; Imidazolium, 1-allyl-3-octyl-, bromide
Recommended Uses: Research, chemical synthesis, electrochemistry
Manufacturer Contact: Customer service line available on supplier website
Emergency Contact: Local poison control center, regional emergency services
CAS Number: 684248-58-2
UN Number: Not assigned

Hazard Identification

GHS Classification: Eye irritation, Skin irritation, Acute toxicity—oral
Signal Word: Warning
Hazard Statements: Causes eye irritation, causes skin irritation, harmful if swallowed
Precautionary Statements: Avoid contact with eyes, skin, and clothing; avoid ingestion
Pictograms: Exclamation mark
Other Hazards: Environmental release may impact aquatic life
Label Elements: Proper labeling ensures safe laboratory and industrial handling
Potential Health Effects: Irritation to skin, eyes, respiratory tract; accidental exposure can result in gastrointestinal symptoms

Composition / Information on Ingredients

Chemical: 1-Allyl-3-Octylimidazolium Bromide
Common Name: AOIB
Purity: >97% (as supplied for most synthesis work)
Impurities: Trace imidazole, water <1%
Ingredients Contribution to Hazard: Imidazolium salts are known irritants

First Aid Measures

Eye Contact: Rinse gently with water for 15 minutes, remove contact lenses, seek medical attention
Skin Contact: Wash thoroughly with soap and water, remove contaminated clothing, seek help if irritation develops
Inhalation: Move to fresh air, provide oxygen if breathing is difficult, consult a healthcare provider
Ingestion: Rinse mouth, drink water, seek emergency medical care, do not induce vomiting
General Advice: Take SDS to the clinic, describe the exposure and symptoms clearly, watch for delayed symptoms

Fire-Fighting Measures

Suitable Extinguishing Media: CO2, dry chemical, alcohol-resistant foam
Unsuitable Media: Direct water stream may spread chemicals
Special Hazards: Combustion may form toxic fumes—carbon monoxide, nitrogen oxides, hydrogen bromide
Protective Equipment: Wear full protective clothing, self-contained breathing apparatus
Firefighting Instructions: Contain runoff, avoid inhalation of gases, remove undamaged containers if safe
Combustibility: May support combustion but unlikely to ignite easily under standard storage

Accidental Release Measures

Personal Precautions: Avoid direct contact, ventilate area, use protective clothing and gloves
Environmental Precautions: Prevent entry into water systems, drains, and soil
Methods for Clean-up: Absorb with non-combustible material such as sand, collect in chemical waste containers, wash residues with water
Containment Techniques: Isolate spill area, minimize spread, use barriers when appropriate
Decontamination: Surface clean with detergent and flush with copious water

Handling and Storage

Handling: Use chemical fume hood, wear personal protective equipment, avoid spills and aerosol generation
Hygiene Measures: Wash hands before meals, avoid eating or drinking in work area, change contaminated clothing promptly
Storage Conditions: Store in cool, well-ventilated area, keep container tightly closed
Incompatibles: Strong oxidizers, strong acids, reactive metals
Shelf Life: Stable under recommended storage, avoid extended exposure to air or sunlight
Packaging: Use tightly sealed, labeled containers resistant to corrosion

Exposure Controls and Personal Protection

Occupational Exposure Limits: No established OSHA or ACGIH limits specific to AOIB
Engineering Controls: Use fume hood, local exhaust ventilation
Personal Protection: Safety glasses or goggles, impervious gloves (nitrile recommended), lab coat or coveralls
Respiratory Protection: Use NIOSH-approved respirator for dusts or mists if aerosol risk exists
Environmental Controls: Use closed systems or suitable exhaust, avoid releases outside workplace containment
Monitoring: Employ regular checks for chemical exposure in high-use labs

Physical and Chemical Properties

Appearance: Pale yellow to white solid or semi-solid
Odor: Mild, characteristic of imidazolium salts
pH: (aqueous solution): 6-8
Melting Point: 73–78°C
Boiling Point: Decomposes before boiling
Flash Point: >140°C (estimate)
Water Solubility: Moderate (miscible at lab concentrations)
Other Solubilities: Soluble in polar organic solvents (methanol, DMSO)
Density: Approximately 1.1–1.2 g/cm³
Vapor Pressure: Low at ambient conditions
Partition Coefficient: Not available
Decomposition Temperature: >200°C
Viscosity: Thick liquid at room temperature when pure

Stability and Reactivity

Chemical Stability: Stable under normal laboratory and industrial working conditions
Incompatible Materials: Strong oxidizers (bleach, peroxides), concentrated acids, reducing agents
Hazardous Reactions: Can form toxic or corrosive gases with strong acids or oxidizers
Decomposition Products: Carbon oxides, imidazole derivatives, hydrogen bromide gas
Conditions to Avoid: Excessive heat, open flame, sources of ignition, alkaline environments

Toxicological Information

Acute Toxicity (Oral): LD50 not precisely known, harmful if ingested—gastrointestinal symptoms, oral and throat irritation
Acute Toxicity (Dermal): Prolonged exposure may cause moderate skin irritation
Inhalation: Dusts or aerosols may induce coughing, shortness of breath, nasal irritation
Chronic Effects: Repeated or prolonged exposure may lead to dermatitis, no known carcinogenicity
Sensitization: Not established, watch for delayed onsets
Symptoms of Overexposure: Nausea, vomiting, redness or soreness at site of contact

Ecological Information

Aquatic Toxicity: Not classified, but imidazolium compounds documented to pose hazard for water organisms at higher concentrations
Persistence and Degradability: Slow biodegradation expected, can persist under low-oxygen conditions
Bioaccumulative Potential: Limited, due to moderate solubility and structure
Mobility in Soil: Moderately mobile, partitioning depends on environmental pH
Other Adverse Effects: Avoid direct discharge, always adhere to local environmental rules

Disposal Considerations

Disposal Method: Incinerate in approved chemical waste facility, follow guidelines for hazardous organic salts
Container Handling: Triple rinse before recycling or discarding containers
Legal Requirements: Comply with local, state, national hazardous waste regulations
Other Recommendations: Do not flush to sewage, do not release to surface water

Transport Information

UN Number: Not regulated for ground, air, or sea transport under typical quantities
Proper Shipping Name: 1-Allyl-3-Octylimidazolium Bromide
Transport Hazard Class: Not classified as dangerous for transport by most regulatory agencies
Packing Group: None assigned
Marine Pollutant: Avoid marine discharge due to potential aquatic impact
Special Precautions: Secure container to prevent spillage, label clearly with chemical name

Regulatory Information

Workplace Regulations: Hazard Communication Standard applies to laboratory and industrial settings
TSCA Status: Not listed specifically, handle as regulated new chemical entity
REACH Registration: Manufacturer or importer responsible for compliance with REACH protocols in Europe
Other International Regulations: Review regional chemical safety obligations, including labeling and registration requirements
Labeling Requirements: Compliant safety and hazard labels required on all containers in workplace
Worker Protection: Personal protective equipment mandatory for exposure risk