2,4-diisocyanato-1-methylbenzene

C9H6N2O2

CAS584-84-9
GHS08 Gefahrensymbol: Gesundheitsgefahr – Gesundheitsgefahr
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
Danger

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Identification

CAS Number
584-84-9
EC Number
209-544-5
UN Number
2078
Index Number
615-006-00-4
PubChem CID
11443

Physical-chemical properties

Molecular Formula
C9H6N2O2
Molar Mass
174.16 g/mol
IUPAC Name
2,4-diisocyanato-1-methylbenzene

Chemical Identifiers

InChI
InChI=1S/C9H6N2O2/c1-7-2-3-8(10-5-12)4-9(7)11-6-13/h2-4H,1H3
InChI Key
DVKJHBMWWAPEIU-UHFFFAOYSA-N

Overview

2,4-diisocyanato-1-methylbenzene (CAS 584-84-9) is an aromatic diisocyanate compound with highly reactive isocyanate functional groups and significant industrial applications. This organic compound, also known by its IUPAC designation 2,4-diisocyanato-1-methylbenzene, represents a crucial building block in the polyurethane and polymer chemistry industry. With a molecular formula of C9H6N2O2 and molecular weight of 174.16 g/mol, this substance belongs to the family of aromatic diisocyanates, characterized by two highly reactive NCO groups attached to a methylated benzene ring. The compound's structure provides excellent reactivity for polymerization reactions while maintaining thermal stability in finished products. Safety considerations are paramount when handling this material, as it carries multiple hazard classifications including carcinogenicity (Category 2), acute toxicity, respiratory sensitization, and skin sensitization properties. The substance requires careful handling protocols due to its Classification 6.1 status under ADR transport regulations and displays GHS08 and GHS06 pictograms with a "Danger" signal word. Unlike simpler aromatic compounds such as chloromethylbenzene or N-methylaniline, this diisocyanate demands specialized storage conditions and employee protection measures. Primary industrial applications include polyurethane foam production, elastomer manufacturing, and specialty coating formulations. The compound serves as a key intermediate in producing flexible polyurethane foams for automotive, furniture, and construction industries. Additionally, it functions as a crosslinking agent in high-performance adhesives and sealants where chemical resistance and durability are essential. OYSI maintains reliable supply chains for 2,4-diisocyanato-1-methylbenzene, ensuring consistent availability for European industrial customers requiring this specialized chemical intermediate.

Safety & Classification

Danger
Classification:

Carc. 2; Acute Tox. 2 *; STOT SE 3; Skin Irrit. 2; Eye Irrit. 2; Resp. Sens. 1; Skin Sens. 1; Aqu...

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H351

Suspected of causing cancer.

H330

Fatal if inhaled.

H335

May cause respiratory irritation.

H315

Causes skin irritation.

H319

Causes serious eye irritation.

H334

May cause allergy or asthma symptoms or breathing difficulties if inhaled.

H317

May cause an allergic skin reaction.

H412

Harmful to aquatic life with long lasting effects.

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

Fatal

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

Irritant

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:

Eye Contact

Irritant

Measures if substance gets into the eyes

First Aid Actions

  • +P305IF IN EYES:
  • +P351Rinse cautiously with water for several minutes.
  • +P338Remove contact lenses, if present and easy to do. Continue rinsing.
  • +P313Get medical advice/attention.

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 Number2078
ADR Class6.1
Packing GroupII
Tunnel CodeD/E
Proper Shipping NameToluendiisocyanat, technisch, flüssig
Marine PollutantNo

Frequently Asked Questions

What is 2,4-diisocyanato-1-methylbenzene?

2,4-diisocyanato-1-methylbenzene is an aromatic diisocyanate compound with the molecular formula C9H6N2O2 and CAS number 584-84-9. This organic chemical belongs to the isocyanate family and has a molecular weight of 174.16 g/mol. It is classified as a hazardous substance with multiple health risks including carcinogenic properties, acute toxicity, and respiratory sensitization potential, requiring careful handling in industrial applications.

What are the physicochemical properties of 2,4-diisocyanato-1-methylbenzene?

2,4-diisocyanato-1-methylbenzene is typically a liquid at room temperature with characteristic chemical properties common to aromatic isocyanates. As an organic compound containing reactive isocyanate groups, it exhibits high reactivity with water and alcohols. The substance requires careful handling due to its volatile nature and tendency to react with moisture in air, forming polyurea compounds and releasing carbon dioxide.

What is 2,4-diisocyanato-1-methylbenzene used for?

2,4-diisocyanato-1-methylbenzene is primarily used as a chemical intermediate in the production of polyurethane materials. It serves as a building block for manufacturing flexible and rigid polyurethane foams, coatings, adhesives, and elastomers. The compound is also utilized in specialized chemical synthesis processes and as a crosslinking agent in various polymer applications within the chemical and materials industries.

How to handle 2,4-diisocyanato-1-methylbenzene safely?

2,4-diisocyanato-1-methylbenzene must be handled with appropriate respiratory protection including full-face respirators with organic vapor cartridges. Chemical-resistant gloves, protective clothing, and eye protection are mandatory due to its skin and eye irritation properties. Work should be conducted in well-ventilated areas or under fume hoods, as the substance can cause respiratory sensitization and has acute toxicity potential.

How to store 2,4-diisocyanato-1-methylbenzene correctly?

2,4-diisocyanato-1-methylbenzene should be stored in tightly sealed containers in a cool, dry place away from moisture and heat sources. The storage area must be well-ventilated and separated from incompatible materials such as water, alcohols, and strong bases. Containers should be made of suitable materials resistant to isocyanates, and storage temperatures should be controlled to prevent decomposition or unwanted reactions.

What to do in case of contact with 2,4-diisocyanato-1-methylbenzene?

In case of skin contact with 2,4-diisocyanato-1-methylbenzene, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water. For eye contact, flush immediately with clean water for at least 15 minutes. If inhaled, move the person to fresh air immediately. Due to its acute toxicity classification, seek immediate medical attention in all cases of exposure and provide safety data sheet information to medical personnel.

How to dispose of 2,4-diisocyanato-1-methylbenzene appropriately?

2,4-diisocyanato-1-methylbenzene must be disposed of as hazardous waste according to local and national regulations. The substance cannot be discharged into sewers or water systems due to its environmental hazard classification. Disposal should be carried out by licensed waste management companies specialized in handling toxic and carcinogenic materials, following proper neutralization procedures when applicable.

How to transport 2,4-diisocyanato-1-methylbenzene?

2,4-diisocyanato-1-methylbenzene is classified as ADR Class 6.1 (Toxic substances) Packing Group II for transportation. It must be packaged in approved containers meeting UN specifications and labeled with appropriate hazard placards. Transport vehicles require proper documentation including transport documents and emergency response information. Only trained personnel should handle the transportation, following all dangerous goods regulations for toxic substances.

Is 2,4-diisocyanato-1-methylbenzene subject to specific regulations?

2,4-diisocyanato-1-methylbenzene is subject to extensive regulatory oversight under REACH and CLP regulations in Europe. Its classification as Carcinogenic Category 2 and Respiratory Sensitizer Category 1 places it under strict labeling and handling requirements. The substance requires safety data sheets, appropriate hazard communication, and may be subject to authorization or restriction procedures depending on its intended use and exposure scenarios.

Where to buy 2,4-diisocyanato-1-methylbenzene in Europe?

2,4-diisocyanato-1-methylbenzene is available through OYSI, a specialized European distributor of technical chemicals. As a professional chemical supplier, OYSI can provide this regulated substance to qualified industrial customers with appropriate documentation and safety requirements. Due to its hazardous classification, purchases typically require verification of proper handling capabilities and intended use documentation from buyers.

Data Sources

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