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Material Safety Data Sheet: 5-Nitrobenzotriazole

Identification

Product Name: 5-Nitrobenzotriazole
Chemical Formula: C6H3N4O2
CAS Number: 94-97-3
Synonyms: Nitrobenzotriazole, 5-Nitro-1,2,3-benzotriazole
Use: Corrosion inhibitor in metalwork, chemical synthesis intermediate
Supplier Details: Industrial chemical distributors, specialty chemical suppliers
Emergency Contact: Regional Poison Control Center, local fire department, supplier safety hotline

Hazard Identification

GHS Classification: Acute toxicity (oral, category 4), Skin irritation (category 2), Eye irritation (category 2A), Environmental hazard (aquatic chronic, category 2)
Signal Word: Warning
Hazard Statements: Harmful if swallowed. Causes skin and eye irritation. Toxic to aquatic life with long lasting effects.
Pictograms: Exclamation mark, Environment
Primary Routes of Exposure: Ingestion, skin contact, eye contact, inhalation of dust
Potential Health Effects: May cause skin rash, redness, or itching. Possible eye redness and pain. Ingestion can result in nausea, headache, and gastrointestinal upset.
Chronic Effects: Prolonged exposure can damage skin or respiratory system. Contains nitro compounds that may affect blood and liver function upon long-term exposure.

Composition / Information on Ingredients

Chemical Name: 5-Nitrobenzotriazole
Concentration: >99%
CAS Number: 94-97-3
Other Components: Trace impurities, less than 1% (unreacted starting materials, manufacturing by-products)
Stabilizers / Additives: None reported in pure product
Impurities: Not expected to pose significant hazard based on current analytical data

First Aid Measures

Eye Contact: Rinse thoroughly with plenty of water for at least 15 minutes, holding eyelids open. Remove contact lenses if present and easy to do. Seek immediate medical attention.
Skin Contact: Wash affected area with plenty of soap and water for at least 15 minutes. Remove contaminated clothing. Get medical help if irritation persists.
Inhalation: Move to fresh air. Rest in position comfortable for breathing. Get medical advice if symptoms like cough, dizziness, or headache occur.
Ingestion: Rinse mouth. Never induce vomiting unless instructed by medical personnel. Drink a small amount of water if conscious. Contact poison control or call a doctor immediately.
Additional Advice: Make sure responders use personal protection like gloves and goggles. Show medical team this sheet if possible.

Fire-Fighting Measures

Suitable Extinguishing Media: Water mist, dry chemical powder, foam, or carbon dioxide
Unsuitable Media: Straight water jets may spread material
Hazardous Combustion Products: Nitrogen oxides, carbon dioxide, carbon monoxide
Specific Hazards: Decomposition in heat or fire releases toxic gases. Dust-air mixtures may form explosive clouds.
Protective Equipment for Firefighters: Full protective suit, self-contained breathing apparatus
Additional Information: Use water spray to cool closed containers exposed to fire. Avoid runoff into watercourses.

Accidental Release Measures

Personal Precautions: Wear gloves, eye protection, and dust mask. Evacuate unprotected personnel.
Environmental Precautions: Prevent entry into drains, surface water, or soil. Notify authorities in case of significant spill.
Containment: Avoid dust generation. Contain spill using inert absorbent like sand. Do not touch spilled material.
Cleanup Procedures: Use non-sparking tools. Sweep up and place into labeled, sealed containers for disposal. Wash area with plenty of water after removal.
Disposal: Collect for proper disposal in accordance with local regulations.

Handling and Storage

Handling: Avoid breathing dust. Prevent contact with skin, eyes, and clothing. Wash thoroughly after handling and before eating or drinking. Use only with adequate ventilation.
Conditions for Safe Storage: Keep container tightly closed in a dry, cool, and well-ventilated place, away from heat sources, sparks, and incompatible substances.
Incompatibles: Strong acids, strong bases, oxidizing agents, reducing agents
Storage Class: Chemical Storage (non-flammable, toxic solid)
Special Requirements: Store away from direct sunlight and sources of moisture

Exposure Controls and Personal Protection

Engineering Controls: Work under a fume hood or local ventilation system. Use natural ventilation only if dust generation is highly unlikely.
Exposure Limits: No specific occupational exposure limit assigned; use general guidelines for nuisance dust (10 mg/m3 total dust, 5 mg/m3 respirable fraction)
Personal Protective Equipment: Chemical safety goggles, gloves (nitrile or neoprene), lab coat or apron, approved dust mask or respirator (P2 rating or above) if dust creation expected
Hygiene Measures: Wash hands before breaks and after work. Avoid eating, drinking, or smoking while working. Wash contaminated clothing before reuse.

Physical and Chemical Properties

Appearance: Pale yellow to beige crystalline powder
Odor: Slight, characteristic
Molecular Weight: 163.12 g/mol
Melting Point: 146–150°C
Boiling Point: Decomposes before boiling
Density: Approximately 1.7 g/cm³
Solubility: Low in water, good in acetone and organic solvents
Vapor Pressure: Not significant at room temperature
pH: Not applicable (solid)
Partition Coefficient: Not available
Flash Point: Not available
Auto-ignition Temperature: Not available
Explosive Properties: Dust may present explosion hazard if suspended in air and exposed to ignition source
Oxidizing Properties: Does not display strong oxidation under standard conditions

Stability and Reactivity

Chemical Stability: Stable in normal conditions of use and storage
Conditions to Avoid: High temperatures, open flames, sources of ignition, moisture
Incompatible Materials: Strong bases, strong acids, reducing and oxidizing agents
Decomposition Products: Nitrogen oxides, carbon oxides, irritating organic fragments
Polymerization: Not known to polymerize spontaneously
Reactivity: Generally unreactive if stored in original sealed container under cool, dry conditions

Toxicological Information

Acute Toxicity: Oral LD50 in rats reported between 200–500 mg/kg
Skin Irritation: Causes moderate skin irritation on direct contact
Eye Irritation: Produces pain, redness, possible corneal injury
Inhalation: Dust inhalation leads to respiratory tract irritation, cough, or difficulty breathing
Chronic Toxicity: Prolonged or repeated exposure could lead to liver or blood changes (information based on related nitro compounds)
Carcinogenicity: Not listed as a carcinogen by NTP, IARC, OSHA
Mutagenicity: Not enough evidence for mutagenic potential
Other Effects: Allergic reactions rare but possible with prolonged skin exposure

Ecological Information

Aquatic Toxicity: Harmful to fish and invertebrates, long-term toxic effects observed in aquatic life
Bioaccumulation: No significant bioaccumulation predicted based on structure and limited data
Mobility in Soil: Binds to organic matter, limited mobility in environment
Persistence and Degradability: Degrades slowly under aerobic conditions, faster in light or strong oxidizing environments
Other Adverse Effects: Do not allow product to reach groundwater, water bodies, or sewage systems
Regulatory Listings: Not specifically listed under priority pollutants, overall aquatic hazard highlighted by manufacturers

Disposal Considerations

Waste Generators: Dispose at authorized chemical waste facility
Methods of Disposal: Burn in a chemical incinerator equipped with afterburner and scrubber, neutralize using permitted industrial waste process
Container Disposal: Triple rinse and destroy by puncturing, then landfill bulk packaging in accordance with local laws
Special Precautions: Do not discharge concentrated residues into drains or ground
RCRA Hazard Code: Not classified, handle as hazardous organic waste where required

Transport Information

UN Number: Not assigned/suspected
Shipping Name: 5-Nitrobenzotriazole
Hazard Class: Not classified as dangerous for transport under most globally recognized frameworks
Packing Group: None
Labeling Requirements: None beyond standard chemical marking, unless transported in large ≤ containers under local regulation
Transport Method Recommendations: Avoid physical impact, keep away from moisture and high temperature during transit. Notify receiving party upon arrival if shipping large quantities.
Environmental Hazards: Transport in secure packaging to prevent accidental environmental release if carton or drum ruptures

Regulatory Information

TSCA Status: Listed or complies with TSCA regulations in USA
EINECS/ELINCS: Listed (EINECS 202-274-7)
REACH Registration: Exempt or pre-registered under EU law (verify for current year)
SARA/Superfund: Not subject to SARA Title III reporting, though environmental release of nitro derivatives may be regulated
Canadian WHMIS: Not controlled, meets regulatory compliance
OSHA Hazard: Classified as hazardous based on acute toxicity and irritation
Labeling Requirements: Product identity, supplier identifier, hazard pictograms, relevant hazard and precautionary statements per GHS
Other Local Regulations: Review regional environmental and occupational health laws before use or storage. Check restrictions for water discharge in municipalities.