2,4,4-trimethylpent-1-ene
C8H16
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Identification
- CAS Number
- 107-39-1
- EC Number
- 203-486-4
- UN Number
- 2050
- Index Number
- 601-031-00-8
- PubChem CID
- 7868
Physical-chemical properties
- Molecular Formula
- C8H16
- Molar Mass
- 112.21 g/mol
- IUPAC Name
- 2,4,4-trimethylpent-1-ene
Chemical Identifiers
- InChI
- InChI=1S/C8H16/c1-7(2)6-8(3,4)5/h1,6H2,2-5H3
- InChI Key
- FXNDIJDIPNCZQJ-UHFFFAOYSA-N
Overview
2,4,4-trimethylpent-1-ene (CAS 107-39-1) is a branched alkene hydrocarbon with high flammability and moderate environmental impact potential. This highly branched octene represents an important intermediate in petrochemical synthesis and organic chemistry applications. With its molecular formula C8H16 and molecular weight of 112.21 g/mol, 2,4,4-trimethylpent-1-ene exhibits characteristic properties of substituted alkenes, featuring a terminal double bond and multiple methyl substituents that significantly influence its reactivity profile. The compound's structural complexity, with three methyl branches including a quaternary carbon center, makes it particularly valuable in specialized chemical transformations. From a safety perspective, this substance requires careful handling due to its classification as a Category 2 flammable liquid, warranting the danger signal word and flame pictogram under GHS regulations. Additionally, its Aquatic Chronic 2 classification indicates potential long-term environmental effects, necessitating appropriate containment and disposal protocols. The ADR Class 3 designation reflects its transportation requirements as a flammable liquid. Industrial applications for 2,4,4-trimethylpent-1-ene include its use as a chemical intermediate in polymer synthesis, where its branched structure can influence polymer properties, and in the production of specialty chemicals requiring controlled stereochemistry. The compound also serves in research applications studying alkene chemistry, particularly in contexts involving steric hindrance effects. Unlike simpler alkenes such as those derived from propylbenzene systems, this heavily substituted olefin offers unique selectivity advantages in certain synthetic pathways. OYSI maintains reliable supply chains for 2,4,4-trimethylpent-1-ene to support European chemical manufacturing and research requirements.
Safety & Classification
Flam. Liq. 2; Aquatic Chronic 2
GHS Pictograms
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
Transport (ADR)
| UN Number | 2050 |
| ADR Class | 3 |
| Packing Group | II |
| Tunnel Code | D/E |
| Proper Shipping Name | alpha-Diisobutylen |
| Marine Pollutant | No |
Frequently Asked Questions
What is 2,4,4-trimethylpent-1-ene?
2,4,4-trimethylpent-1-ene is an alkene hydrocarbon with the molecular formula C8H16 and CAS number 107-39-1. This branched olefin features a pentene backbone with three methyl substituents positioned at carbons 2, 4, and 4, creating a highly branched structure. With a molecular weight of 112.21 g/mol, it belongs to the class of volatile organic compounds and is classified as a flammable liquid with potential environmental impact on aquatic ecosystems.
What are the physicochemical properties of 2,4,4-trimethylpent-1-ene?
2,4,4-trimethylpent-1-ene is a colorless liquid at room temperature with a characteristic hydrocarbon odor. As a branched alkene, it exhibits low water solubility but good solubility in organic solvents such as alcohols, ethers, and other hydrocarbons. The compound has a relatively low boiling point typical of C8 alkenes and high volatility. Its branched structure affects its physical properties compared to linear octenes, including density and viscosity characteristics.
What is 2,4,4-trimethylpent-1-ene used for?
2,4,4-trimethylpent-1-ene serves primarily as a chemical intermediate in organic synthesis and polymer production. It is commonly used in the manufacture of specialty chemicals, as a monomer or co-monomer in polymerization reactions, and as a starting material for the synthesis of more complex organic compounds. The compound also finds applications in the production of surfactants, lubricant additives, and other industrial chemicals where its specific branched alkene structure provides desired properties.
How to handle 2,4,4-trimethylpent-1-ene safely?
2,4,4-trimethylpent-1-ene requires careful handling due to its flammable nature and environmental hazards. Essential personal protective equipment includes chemical-resistant gloves, safety goggles, and appropriate respiratory protection when ventilation is inadequate. Work should be conducted in well-ventilated areas away from ignition sources, heat, and open flames. Ground all equipment to prevent static electricity buildup, and ensure emergency shower and eyewash stations are readily accessible during handling operations.
How to store 2,4,4-trimethylpent-1-ene correctly?
2,4,4-trimethylpent-1-ene must be stored in a cool, dry, well-ventilated area away from heat sources, sparks, and open flames. Use only approved containers and storage facilities designed for flammable liquids. Keep containers tightly closed and store away from oxidizing agents and incompatible materials. Maintain storage temperatures below the flashpoint and implement appropriate fire suppression systems. Regular inspection of storage containers for leaks or damage is essential to prevent environmental contamination.
What to do in case of contact with 2,4,4-trimethylpent-1-ene?
Immediate action is required upon contact with 2,4,4-trimethylpent-1-ene. For skin contact, remove contaminated clothing and wash affected area thoroughly with soap and water for at least 15 minutes. In case of eye contact, flush immediately with clean water for 15 minutes while holding eyelids open. If inhaled, move person to fresh air immediately. For ingestion, do not induce vomiting and seek immediate medical attention. Contact emergency services if severe symptoms develop.
How to dispose of 2,4,4-trimethylpent-1-ene properly?
2,4,4-trimethylpent-1-ene disposal must comply with local and European waste regulations due to its flammable and environmental hazard classification. The compound should be treated as hazardous waste and disposed of through licensed waste management facilities capable of handling flammable organic solvents. Incineration at appropriate high-temperature facilities or recovery through distillation are acceptable methods. Never dispose of down drains or into the environment, as it poses risks to aquatic ecosystems.
How to transport 2,4,4-trimethylpent-1-ene?
2,4,4-trimethylpent-1-ene is classified under ADR Class 3 (flammable liquids), Packing Group II, indicating medium danger level for transport. Transportation requires UN-approved packaging suitable for flammable liquids and proper hazard labeling including flammable liquid placards. Vehicles must be equipped with appropriate fire extinguishing equipment and drivers must hold ADR certification. Transport documents must include proper shipping names, hazard identification numbers, and emergency response information according to dangerous goods regulations.
Is 2,4,4-trimethylpent-1-ene subject to specific regulations?
2,4,4-trimethylpent-1-ene is regulated under European CLP Regulation with hazard classifications Flam. Liq. 2 and Aquatic Chronic 2, requiring appropriate labeling with GHS02 and GHS09 pictograms. It falls under REACH registration requirements for chemical substances. The compound is not currently listed as a Substance of Very High Concern (SVHC). Transportation is governed by ADR regulations for dangerous goods, and workplace exposure may be subject to occupational health and safety directives.
Where to buy 2,4,4-trimethylpent-1-ene in Europe?
2,4,4-trimethylpent-1-ene is available through OYSI, a specialized European distributor of technical chemicals serving industrial customers across the continent. OYSI provides reliable supply chains, technical support, and regulatory compliance assistance for this and other specialty chemicals. As experienced chemical distributors, they ensure proper packaging, documentation, and delivery according to ADR transport regulations. Contact OYSI directly for pricing, availability, and specific grade requirements for your industrial applications.
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2,4,4-trimethylpent-1-ene is a dangerous good. We support you with labeling, packaging, and transport documentation.
Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.