2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile

C8Cl4N2

CAS1897-45-6
GHS08 Gefahrensymbol: Gesundheitsgefahr – Gesundheitsgefahr
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
GHS05 Gefahrensymbol: Ätzend – Ätzwirkung
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
1897-45-6
EC Number
217-588-1
UN Number
2761
Index Number
608-014-00-4
PubChem CID
15910

Physical-chemical properties

Molecular Formula
C8Cl4N2
Molar Mass
265.90 g/mol
IUPAC Name
2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile

Chemical Identifiers

InChI
InChI=1S/C8Cl4N2/c9-5-3(1-13)6(10)8(12)7(11)4(5)2-14
InChI Key
CRQQGFGUEAVUIL-UHFFFAOYSA-N

Overview

2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile (CAS 1897-45-6) is a highly chlorinated aromatic compound with significant toxicological properties and industrial applications. This tetrachlorinated benzene derivative represents a specialized chemical intermediate characterized by its unique substitution pattern of four chlorine atoms and two nitrile groups on the benzene ring. The compound exhibits a molecular formula of C8Cl4N2 with a molecular weight of 265.9 g/mol, placing it among the heavier halogenated aromatic compounds used in industrial processes. The safety profile of 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile requires careful attention due to its classification as a Category 2 carcinogen and acute toxicity hazard. The substance carries the danger signal word and multiple GHS pictograms including GHS08, GHS06, GHS05, and GHS09, reflecting its potential for serious health effects, acute toxicity, corrosive properties, and environmental hazards. Its classification under ADR Class 6.1 as a toxic substance necessitates specialized handling and transportation protocols. The compound's chlorinated aromatic structure makes it valuable in several industrial applications, particularly as an intermediate in the synthesis of specialized pharmaceuticals and agrochemicals where its reactivity profile proves advantageous. Additionally, it serves as a precursor in the production of high-performance polymers and advanced materials requiring specific chlorination patterns. Like other halogenated compounds such as 1-chloro-4-isocyanatobenzene, it finds use in specialized chemical transformations where selective reactivity is crucial. OYSI provides access to 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile for qualified industrial customers requiring this specialized chemical intermediate for their manufacturing processes.

Safety & Classification

Danger
Classification:

Carc. 2; Acute Tox. 2 *; STOT SE 3; Eye Dam. 1; Skin Sens. 1; Aquatic Acute 1; Aquatic Chronic 1

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.

H318

Causes serious eye damage.

H317

May cause an allergic skin reaction.

H400

Very toxic to aquatic life.

H410

Very toxic 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

Harmful

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 Number2761
ADR Class6.1
Packing GroupII
Tunnel CodeD/E
Proper Shipping NameChlorothalonil (ISO)
Marine PollutantNo

Frequently Asked Questions

What is 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile?

2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile is a chlorinated aromatic compound with the molecular formula C8Cl4N2 and CAS number 1897-45-6. This chemical features a benzene ring substituted with four chlorine atoms and two nitrile groups, giving it a molecular weight of 265.9 g/mol. It is classified as a hazardous substance with multiple danger classifications including potential carcinogenicity, acute toxicity, and environmental hazards.

What are the physicochemical properties of 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile?

2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile is a solid crystalline compound at room temperature due to its chlorinated aromatic structure. The presence of four chlorine atoms and two nitrile groups significantly affects its physical properties, making it relatively stable but poorly soluble in water. Its molecular structure with multiple electron-withdrawing groups contributes to its chemical stability and low volatility under normal conditions.

What is 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile used for?

2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile is primarily used as a chemical intermediate in organic synthesis and pharmaceutical manufacturing. Its unique structure with both chlorine substituents and nitrile groups makes it valuable for producing specialized compounds in the chemical industry. Due to its hazardous classification, its use is typically restricted to professional industrial applications under controlled conditions with appropriate safety measures.

How to safely handle 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile?

2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile requires strict safety protocols due to its acute toxicity and potential carcinogenic properties. Essential personal protective equipment includes chemical-resistant gloves, safety goggles, and respiratory protection. Work should be conducted in well-ventilated areas or under fume hoods to prevent inhalation. Skin and eye contact must be avoided at all costs, and emergency washing facilities should be readily accessible during handling operations.

How to properly store 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile?

2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile must be stored in a cool, dry, well-ventilated area away from heat sources and incompatible materials. The substance should be kept in tightly sealed, chemically compatible containers to prevent contamination and exposure. Storage areas should be equipped with appropriate containment measures and restricted to authorized personnel only, with clear hazard labeling and emergency procedures readily available.

What to do in case of contact with 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile?

Immediate medical attention is required for any exposure to 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile due to its acute toxicity classification. For skin contact, remove contaminated clothing and flush the affected area with plenty of water for at least 15 minutes. In case of eye contact, rinse immediately with water and seek urgent medical care. If inhaled, move the person to fresh air immediately and contact emergency medical services.

How to properly dispose of 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile?

2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile must be disposed of as hazardous waste through licensed waste management companies in accordance with local and European regulations. The substance cannot be disposed of in regular waste streams due to its toxic and potentially carcinogenic properties. Disposal methods typically include high-temperature incineration at specialized facilities equipped to handle chlorinated organic compounds while preventing environmental contamination.

How to transport 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile?

2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile is classified under ADR Class 6.1 (Toxic substances) Packing Group II, indicating significant transport restrictions. Transportation requires specialized packaging, proper hazard labeling, and documentation in accordance with dangerous goods regulations. Only authorized carriers with appropriate certifications can transport this substance, and emergency response information must accompany shipments to ensure proper handling in case of incidents.

Is 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile subject to specific regulations?

2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile is subject to comprehensive European chemical regulations including REACH registration and CLP classification requirements. Its multiple hazard classifications require strict compliance with occupational safety standards, environmental protection measures, and transport regulations. While not currently listed as a SVHC, its carcinogenic potential and environmental hazards mean it faces stringent use restrictions and reporting obligations across European markets.

Where to buy 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile in Europe?

2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile is available through OYSI, a specialized European distributor of technical chemicals and intermediates. As a professional chemical supplier, OYSI ensures compliance with all regulatory requirements and provides proper documentation, safety data sheets, and technical support. Due to the hazardous nature of this substance, purchases are typically restricted to qualified industrial users with appropriate handling capabilities and regulatory compliance.

Data Sources

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