2,2,3-trimethylbutane
C7H16
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Identification
- CAS Number
- 464-06-2
- EC Number
- 207-346-3
- UN Number
- 1206
- Index Number
- 601-008-00-2
- PubChem CID
- 10044
Physical-chemical properties
- Molecular Formula
- C7H16
- Molar Mass
- 100.20 g/mol
- IUPAC Name
- 2,2,3-trimethylbutane
Chemical Identifiers
- InChI
- InChI=1S/C7H16/c1-6(2)7(3,4)5/h6H,1-5H3
- InChI Key
- ZISSAWUMDACLOM-UHFFFAOYSA-N
Overview
2,2,3-trimethylbutane (CAS 464-06-2) is a branched alkane hydrocarbon with highly flammable properties and significant toxicity hazards. This saturated hydrocarbon belongs to the family of methylated butanes and represents one of the structural isomers of heptane (C7H16). As a highly branched alkane, 2,2,3-trimethylbutane exhibits distinct physical and chemical characteristics compared to its linear counterparts. The compound's molecular structure features three methyl substituents on a butane backbone, resulting in a compact, highly branched configuration that influences its volatility and combustion properties. From a safety perspective, 2,2,3-trimethylbutane presents multiple hazard classifications requiring careful handling protocols. The substance is classified as a Category 2 flammable liquid with aspiration toxicity hazards (Category 1), indicating severe risks if ingested and subsequently aspirated into the respiratory system. Additional safety concerns include skin irritation potential, specific target organ toxicity affecting the central nervous system, and significant aquatic toxicity requiring environmental protection measures during storage and handling. The compound's branched structure makes it particularly valuable in specialized chemical applications where controlled combustion characteristics are essential. Industrial applications typically include use as a reference standard in octane rating studies, as a component in specialized fuel formulations, and as a research chemical for studying hydrocarbon behavior. Like related branched hydrocarbons such as 3-ethyl-3-methylpentane, it serves important roles in petrochemical research and fuel additive development. Professional users requiring 2,2,3-trimethylbutane for technical applications can source this specialized hydrocarbon through OYSI's comprehensive chemical distribution network across Europe.
Safety & Classification
Flam. Liq. 2; Asp. Tox. 1; STOT SE 3; Skin Irrit. 2; Aquatic Acute 1; Aquatic Chronic 1
GHS Pictograms
Flame
GHS02
Flammable. May ignite on contact with air, water, or heat sources.
Health Hazard
GHS08
Serious health hazard. May cause cancer, organ damage, or genetic defects.
Exclamation Mark
GHS07
Harmful. May cause irritation, allergic reactions, or drowsiness.
Environment
GHS09
Environmental hazard. Toxic to aquatic life with long lasting effects.
HHazard Statements (H-Statements)
Describe the nature and severity of the hazard
Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).
First Aid Measures
Inhalation
Measures if vapours or dust are inhaled
First Aid Actions
- +P304IF INHALED:
- +P340Remove person to fresh air and keep comfortable for breathing.
- +P311Call a POISON CENTER/doctor.
Related hazard statements:
Skin Contact
Measures if substance contacts the skin
First Aid Actions
- +P302IF ON SKIN:
- +P352Wash with plenty of water.
- +P361Take off immediately all contaminated clothing.
- +P313Get medical advice/attention.
Related hazard statements:
Ingestion
Measures if substance is accidentally swallowed
First Aid Actions
- +P301IF SWALLOWED:
- +P330Rinse mouth.
- +P331Do NOT induce vomiting.
- +P310Immediately call a POISON CENTER/doctor.
Related hazard statements:
General Measures
Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)
First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.
Transport (ADR)
| UN Number | 1206 |
| ADR Class | 3 |
| Packing Group | II |
| Tunnel Code | D/E |
| Proper Shipping Name | 2,2,3-Trimethylbutan |
| Marine Pollutant | No |
Frequently Asked Questions
What is 2,2,3-trimethylbutane?
2,2,3-trimethylbutane is a branched-chain alkane hydrocarbon with the molecular formula C7H16 and CAS number 464-06-2. This organic compound belongs to the family of saturated hydrocarbons and has a molecular weight of 100.2 g/mol. It is characterized by its highly branched structure, consisting of a butane backbone with three methyl groups attached at specific positions, making it an isomer of heptane with unique physical and chemical properties.
What are the physicochemical properties of 2,2,3-trimethylbutane?
2,2,3-trimethylbutane is a colorless liquid at room temperature with a characteristic hydrocarbon odor. As a nonpolar hydrocarbon, it is practically insoluble in water but readily soluble in organic solvents such as alcohols, ethers, and other hydrocarbons. The compound exhibits typical alkane properties including low density, high volatility, and flammability. Its branched structure influences its boiling point and other physical characteristics compared to linear heptane isomers.
What is 2,2,3-trimethylbutane used for?
2,2,3-trimethylbutane is primarily used as a high-octane component in gasoline formulations due to its excellent anti-knock properties. It serves as a reference standard in analytical chemistry and petroleum research. The compound is also utilized as a solvent in specialized chemical processes and as a starting material for the synthesis of other organic compounds. Its unique branched structure makes it valuable in fuel blending applications where high octane ratings are required.
How to handle 2,2,3-trimethylbutane safely?
2,2,3-trimethylbutane requires careful handling due to its flammable nature and health hazards. Use appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing. Ensure adequate ventilation to prevent vapor accumulation and eliminate ignition sources. The compound can cause skin irritation and respiratory effects, so avoid direct contact and inhalation. Work in well-ventilated areas or use local exhaust ventilation systems to minimize exposure risks.
How to store 2,2,3-trimethylbutane correctly?
2,2,3-trimethylbutane must be stored in a cool, dry, well-ventilated area away from heat sources, sparks, and open flames. Use properly grounded containers made of compatible materials and ensure proper labeling with hazard information. Keep containers tightly closed when not in use and store away from incompatible materials such as strong oxidizing agents. Maintain storage temperatures below the flash point and implement appropriate fire prevention measures in the storage area.
What to do in case of contact with 2,2,3-trimethylbutane?
Immediate action is required following exposure to 2,2,3-trimethylbutane. For skin contact, remove contaminated clothing and wash the affected area thoroughly with soap and water. In case of eye contact, rinse immediately with plenty of clean water for at least 15 minutes and seek medical attention. If inhaled, move the person to fresh air and monitor for respiratory distress. For ingestion, do not induce vomiting and seek immediate medical attention due to aspiration toxicity risks.
How to dispose of 2,2,3-trimethylbutane properly?
2,2,3-trimethylbutane disposal must comply with local, national, and international waste regulations as a hazardous substance. The compound should be disposed of through licensed hazardous waste contractors who can ensure proper treatment or incineration under controlled conditions. Never discharge into sewers, waterways, or soil due to its environmental hazard classification. Consult with waste management specialists to determine the most appropriate disposal method based on quantity and local regulatory requirements.
How to transport 2,2,3-trimethylbutane?
2,2,3-trimethylbutane is classified as ADR Class 3 (flammable liquids), Packing Group II, requiring specific transport protocols. Shipments must use approved packaging and proper hazard labeling including flammable liquid placards. Transport vehicles must comply with ADR regulations for dangerous goods, including appropriate safety equipment and driver certification. Ensure proper documentation accompanies shipments and that carriers are qualified to handle Class 3 dangerous goods according to international transport regulations.
Is 2,2,3-trimethylbutane subject to particular regulations?
2,2,3-trimethylbutane is regulated under various chemical safety frameworks including REACH registration requirements in the European Union and CLP classification as a hazardous substance. The compound is not currently listed as a Substance of Very High Concern (SVHC) but must comply with standard chemical safety regulations. Users must follow proper classification, labeling, and safety data sheet requirements. Industrial users may need to implement risk management measures and comply with occupational exposure limits.
Where to buy 2,2,3-trimethylbutane in Europe?
2,2,3-trimethylbutane is available through OYSI, a trusted European distributor of technical chemicals. OYSI provides high-quality chemical products with proper documentation, safety data sheets, and regulatory compliance support across European markets. As a specialized chemical distributor, OYSI ensures reliable supply chains and technical support for industrial customers requiring this compound. Contact OYSI directly to discuss availability, specifications, and delivery options for your specific requirements in the European market.
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Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.