1-ethenyl-3-methylbenzene

C9H10

CAS100-80-1

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Identification

CAS Number
100-80-1
EC Number
202-889-2
UN Number
2618
PubChem CID
7529

Physical-chemical properties

Molecular Formula
C9H10
Molar Mass
118.18 g/mol
IUPAC Name
1-ethenyl-3-methylbenzene

Chemical Identifiers

InChI
InChI=1S/C9H10/c1-3-9-6-4-5-8(2)7-9/h3-7H,1H2,2H3
InChI Key
JZHGRUMIRATHIU-UHFFFAOYSA-N

Overview

1-ethenyl-3-methylbenzene (CAS 100-80-1) is an aromatic hydrocarbon compound with vinyl functionality and methyl substitution on the benzene ring. This organic compound, also known by its IUPAC name 1-ethenyl-3-methylbenzene, belongs to the family of substituted styrenes and represents an important building block in industrial chemistry. With a molecular formula of C9H10 and molecular weight of 118.18 g/mol, this colorless liquid exhibits typical characteristics of aromatic vinyl compounds. The molecule features a benzene ring substituted with both an ethenyl group (vinyl group) and a methyl group in meta position, giving it unique reactivity patterns that make it valuable for polymerization and chemical synthesis applications. The compound is classified under ADR transport class 3, indicating its flammable nature, which requires appropriate handling and storage precautions. Despite this classification, it presents relatively manageable safety considerations when proper industrial protocols are followed. The vinyl functionality makes it highly reactive in polymerization processes, while the methyl substitution influences both its physical properties and reactivity compared to unsubstituted styrene derivatives. In industrial applications, 1-ethenyl-3-methylbenzene serves primarily as a monomer for specialty polymer production, contributing to the manufacture of high-performance plastics and resins with enhanced properties. It is also utilized in the synthesis of advanced materials and as an intermediate in the production of fine chemicals. Similar to other specialty chemicals like 2-ethylbutyl acetate, it finds use in formulation chemistry where specific molecular characteristics are required. OYSI provides reliable access to 1-ethenyl-3-methylbenzene for European industrial customers, ensuring consistent quality and regulatory compliance for demanding technical applications.

Safety & Classification

No Hazard Classification

This substance is not classified as hazardous according to CLP Regulation (EC) No 1272/2008.

Transport (ADR)

UN Number2618
ADR Class3
Packing GroupIII
Tunnel CodeD/E
Proper Shipping Name3-Vinyltoluen, stabilisiert
Marine PollutantNo

Frequently Asked Questions

What is 1-ethenyl-3-methylbenzene?

1-ethenyl-3-methylbenzene is an aromatic hydrocarbon compound with the molecular formula C9H10 and CAS number 100-80-1. This organic chemical features a benzene ring substituted with both a vinyl group (ethenyl) and a methyl group at specific positions. With a molecular weight of 118.18 g/mol, it belongs to the styrene family of compounds and serves as an important industrial chemical intermediate in various synthetic processes.

What are the physicochemical properties of 1-ethenyl-3-methylbenzene?

1-ethenyl-3-methylbenzene is a colorless to pale yellow liquid at room temperature with a characteristic aromatic odor. As an aromatic hydrocarbon with molecular formula C9H10, it exhibits typical properties of styrene derivatives including low water solubility but good solubility in organic solvents. The compound has a molecular weight of 118.18 g/mol and contains both aromatic and vinyl functional groups, making it reactive toward polymerization reactions.

What is 1-ethenyl-3-methylbenzene used for?

1-ethenyl-3-methylbenzene is primarily used as a chemical intermediate in polymer synthesis and specialty chemical manufacturing. Its vinyl group makes it suitable for polymerization reactions to produce modified polystyrene resins and copolymers. The compound finds applications in the production of adhesives, coatings, and specialty plastics where specific performance characteristics are required. It may also serve as a building block in pharmaceutical and fine chemical synthesis.

How to handle 1-ethenyl-3-methylbenzene safely?

1-ethenyl-3-methylbenzene should be handled using standard organic solvent precautions including wearing appropriate personal protective equipment such as chemical-resistant gloves, safety goggles, and protective clothing. Work should be conducted in well-ventilated areas or under fume extraction to minimize vapor exposure. Avoid contact with skin and eyes, and prevent inhalation of vapors. Keep away from heat sources, sparks, and open flames due to its flammable nature.

How to store 1-ethenyl-3-methylbenzene correctly?

1-ethenyl-3-methylbenzene should be stored in tightly sealed containers in a cool, dry, well-ventilated area away from heat sources and direct sunlight. As a vinyl compound, it may be prone to polymerization, so storage temperatures should be controlled and stabilizers may be present. Keep containers upright and properly labeled. Store away from strong oxidizing agents and incompatible materials. Regular inventory rotation helps ensure product quality and stability.

What to do in case of contact with 1-ethenyl-3-methylbenzene?

In case of skin contact with 1-ethenyl-3-methylbenzene, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water for at least 15 minutes. For eye contact, flush immediately with clean water for 15 minutes while holding eyelids open. If inhaled, move to fresh air immediately. If ingested, do not induce vomiting and seek medical attention. Always consult safety data sheets for complete first aid procedures and contact emergency services if necessary.

How to dispose of 1-ethenyl-3-methylbenzene appropriately?

1-ethenyl-3-methylbenzene must be disposed of according to local, national, and EU waste regulations as a hazardous organic waste. The material should not be discharged to sewers or the environment. Contact licensed waste disposal companies for proper treatment, which may include incineration at appropriate facilities. Empty containers should also be handled as hazardous waste. Always check current waste classification codes and follow applicable REACH and CLP disposal requirements.

How to transport 1-ethenyl-3-methylbenzene?

1-ethenyl-3-methylbenzene is classified under ADR Class 3 (flammable liquids), Packing Group III for transportation purposes. This classification requires appropriate packaging, labeling, and documentation for road transport within Europe. Vehicles must comply with ADR regulations including proper placarding and driver certification. The relatively lower hazard level of Packing Group III allows for certain transport facilitations compared to higher hazard groups, but all ADR safety requirements must still be followed.

Is 1-ethenyl-3-methylbenzene subject to particular regulations?

1-ethenyl-3-methylbenzene is subject to standard EU chemical regulations including REACH registration requirements and CLP classification and labeling regulations. The substance is not currently identified as a Substance of Very High Concern (SVHC) under REACH. Standard industrial chemical handling, storage, and workplace exposure regulations apply. Companies using this material must ensure compliance with relevant occupational health and safety directives and may need to conduct chemical safety assessments depending on usage volumes.

Where to buy 1-ethenyl-3-methylbenzene in Europe?

1-ethenyl-3-methylbenzene is available through OYSI, a specialized European distributor of technical chemicals and industrial raw materials. OYSI can provide this aromatic compound for industrial applications with appropriate documentation including safety data sheets and certificates of analysis. As a professional chemical supplier, OYSI ensures compliance with European regulations and can advise on technical specifications, packaging options, and regulatory requirements for your specific application needs.

Data Sources

Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.