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 polymerization applications. This chemical substance, also known by its molecular formula C9H6N2O2, represents a critical intermediate in the production of polyurethane materials and related polymer systems. With a molecular weight of 174.16 g/mol and EC number 209-544-5, this diisocyanate exhibits the characteristic reactivity profile typical of aromatic isocyanate compounds, making it valuable for various industrial synthesis applications. The compound presents significant safety considerations due to its classification under multiple hazard categories, including carcinogenicity (Category 2), acute toxicity, and respiratory sensitization properties. Its GHS08 and GHS06 pictograms indicate serious health hazards, requiring stringent handling protocols and appropriate personal protective equipment. The substance falls under ADR Class 6.1, reflecting its toxic nature during transportation and storage. Key safety characteristics include potential for skin and eye irritation, respiratory sensitization, and specific target organ toxicity. Unlike simpler aromatic compounds such as N-methylaniline, this diisocyanate requires specialized ventilation systems and confined handling procedures due to its reactive isocyanate functionality. Primary industrial applications include polyurethane foam production, elastomer manufacturing, and specialty coating formulations. The compound serves as a crosslinking agent in polymer chemistry and finds use in adhesive systems where controlled reactivity is essential. OYSI maintains technical-grade availability of 2,4-diisocyanato-1-methylbenzene for qualified industrial customers across European markets, supported by comprehensive safety documentation and regulatory compliance materials.

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 chemical belongs to the toluene diisocyanate (TDI) family and has a molecular weight of 174.16 g/mol. It is classified as a hazardous substance with significant health risks including carcinogenic potential, acute toxicity, and respiratory sensitization properties.

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

2,4-diisocyanato-1-methylbenzene is typically a colorless to pale yellow liquid at room temperature with a sharp, pungent odor. As an isocyanate compound, it is reactive with water and alcohols, forming polyurea and urethane linkages respectively. The substance has low water solubility but dissolves well in organic solvents. Its reactive nature makes it sensitive to moisture and heat.

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

2,4-diisocyanato-1-methylbenzene is primarily used in the production of polyurethane foams, coatings, adhesives, and elastomers. It serves as a key building block in flexible polyurethane foam manufacturing for furniture, automotive seating, and insulation materials. The compound is also utilized in specialty coatings, sealants, and as an intermediate in pharmaceutical and agricultural chemical synthesis.

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

Safe handling of 2,4-diisocyanato-1-methylbenzene requires comprehensive personal protective equipment including respiratory protection, chemical-resistant gloves, and eye protection. Work should be conducted in well-ventilated areas or under fume hoods due to its respiratory sensitization properties. Given its Acute Tox. 2 and Carc. 2 classifications, minimize exposure time and ensure proper training for all personnel handling this substance.

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

2,4-diisocyanato-1-methylbenzene must be stored in tightly sealed containers in a cool, dry place away from moisture, heat sources, and incompatible materials. Keep containers away from water, alcohols, amines, and strong bases which react violently with isocyanates. Storage areas should be well-ventilated and equipped with appropriate emergency equipment. Temperature control is essential to prevent decomposition.

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 affected area with plenty of water for at least 15 minutes. For eye contact, flush with water and seek medical attention. If inhaled, move to fresh air immediately and seek medical help due to respiratory sensitization risks. Never induce vomiting if ingested. Seek immediate medical attention in all exposure cases.

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

2,4-diisocyanato-1-methylbenzene waste must be disposed of through licensed hazardous waste contractors in accordance with local and European waste regulations. The substance cannot be disposed of in regular waste streams due to its toxicity and carcinogenic properties. Containers should be triple-rinsed and the rinse solutions treated as hazardous waste. Incineration at high temperatures in specialized facilities is typically required.

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, requiring specialized transport procedures. Packages must bear appropriate hazard labels and comply with ADR packaging requirements. Transport vehicles need proper placarding and emergency equipment. Drivers must hold ADR certification for Class 6.1 substances, and transport documents must include emergency response information.

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

2,4-diisocyanato-1-methylbenzene is subject to comprehensive European regulations including REACH registration requirements and CLP classification obligations. While not currently listed as an SVHC, its Carc. 2 classification means it falls under carcinogen handling regulations. Users must comply with occupational exposure limits, implement risk management measures, and may require authorization for certain uses under REACH Annex XIV restrictions.

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

2,4-diisocyanato-1-methylbenzene is available through OYSI, a specialized European distributor of industrial chemicals. As a professional chemical supplier, OYSI can provide this regulated substance to qualified industrial customers with appropriate handling capabilities and regulatory compliance. Given the substance's hazardous nature and regulatory requirements, procurement is limited to professional industrial applications with proper safety infrastructure.

Data Sources

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