1,4-dichlorobut-2-ene

C4H6Cl2

CAS764-41-0
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
764-41-0
EC Number
212-121-8
UN Number
2927
Index Number
602-073-00-X
PubChem CID
15122

Physical-chemical properties

Molecular Formula
C4H6Cl2
Molar Mass
124.99 g/mol
IUPAC Name
1,4-dichlorobut-2-ene

Chemical Identifiers

InChI
InChI=1S/C4H6Cl2/c5-3-1-2-4-6/h1-2H,3-4H2
InChI Key
FQDIANVAWVHZIR-UHFFFAOYSA-N

Overview

1,4-dichlorobut-2-ene (CAS 764-41-0) is an organochlorine compound with significant reactivity and classified carcinogenic properties. This unsaturated aliphatic compound, also known by its IUPAC name 1,4-dichlorobut-2-ene, represents a specialized chemical intermediate with molecular formula C4H6Cl2 and molecular weight of 124.99 g/mol. The molecule features a four-carbon chain with a central double bond and chlorine atoms at the terminal positions, creating a highly reactive structure that makes it valuable for specific synthetic applications while requiring careful handling protocols. The compound presents significant safety considerations due to its classification as a Category 1B carcinogen and its acute toxicity profile. With GHS pictograms including GHS08 (health hazard), GHS06 (toxic), GHS05 (corrosive), and GHS09 (environmental hazard), it requires specialized storage, handling, and transportation procedures under ADR Class 6.1. The substance exhibits skin corrosive properties (Category 1B) and poses acute aquatic toxicity risks, necessitating comprehensive risk management strategies in industrial environments. In industrial applications, 1,4-dichlorobut-2-ene serves primarily as a chemical intermediate in organic synthesis, particularly in the production of specialized polymers and pharmaceutical precursors. Its reactive double bond and terminal chlorine substituents enable various coupling reactions and cyclization processes. The compound finds use in research applications involving halogenated organic chemistry, where it may be employed alongside other reactive intermediates such as 2-chloroacetaldehyde for specialized synthetic transformations. Due to its hazardous classification and specialized nature, this compound requires expert handling and is typically supplied to qualified industrial users with appropriate safety infrastructure. OYSI provides 1,4-dichlorobut-2-ene to European customers with comprehensive documentation and regulatory compliance support for professional chemical applications.

Safety & Classification

Danger
Classification:

Carc. 1B; Acute Tox. 2 *; Acute Tox. 3 *; Acute Tox. 3 *; Skin Corr. 1B; Aquatic Acute 1; Aquatic...

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H350

May cause cancer.

H330

Fatal if inhaled.

H311

Toxic in contact with skin.

H301

Toxic if swallowed.

H314

Causes severe skin burns and eye damage.

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

Toxic

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:

Ingestion

Toxic

Measures if substance is accidentally swallowed

First Aid Actions

  • +P301IF SWALLOWED:
  • +P330Rinse mouth.
  • +P331Do NOT induce vomiting.
  • +P310Immediately call a POISON CENTER/doctor.

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 Number2927
ADR Class6.1
Packing GroupII
Tunnel CodeD/E
Proper Shipping Name1,4-Dichlorbut-2-en, cis/trans-Isomere oder Isomerengemisch
Marine PollutantNo

Frequently Asked Questions

What is 1,4-dichlorobut-2-ene?

1,4-dichlorobut-2-ene is an organochlorine compound with the molecular formula C4H6Cl2 and CAS number 764-41-0. This chemical features a four-carbon chain with a double bond between carbons 2 and 3, and chlorine atoms attached to carbons 1 and 4. With a molecular weight of 124.99 g/mol, it is classified as a highly hazardous substance due to its carcinogenic properties and acute toxicity.

What are the physicochemical properties of 1,4-dichlorobut-2-ene?

1,4-dichlorobut-2-ene is typically a colorless to pale yellow liquid at room temperature with a characteristic pungent odor. The compound has limited solubility in water but dissolves readily in organic solvents such as alcohols and ethers. Its double bond structure makes it reactive toward addition reactions, while the chlorine substituents contribute to its overall chemical instability and reactivity profile.

What is 1,4-dichlorobut-2-ene used for?

1,4-dichlorobut-2-ene serves primarily as a chemical intermediate in organic synthesis and pharmaceutical manufacturing. It is used in the production of specialized chemicals, research applications, and as a building block for more complex organic molecules. Due to its high toxicity and carcinogenic classification, its use is strictly limited to professional industrial applications with appropriate safety controls and regulatory compliance.

How to handle 1,4-dichlorobut-2-ene safely?

1,4-dichlorobut-2-ene requires extreme caution during handling due to its Carc. 1B and Acute Tox. 2-3 classifications. Essential protective equipment includes chemical-resistant gloves, full face protection, and appropriate respiratory protection. Work must be conducted in well-ventilated areas or under fume hoods. Avoid skin contact and inhalation completely, as the substance is both highly toxic and carcinogenic.

How to store 1,4-dichlorobut-2-ene correctly?

1,4-dichlorobut-2-ene must be stored in tightly sealed containers in a cool, dry, well-ventilated area away from heat sources and incompatible materials. Storage areas should be equipped with appropriate containment systems and restricted access due to the substance's carcinogenic nature. Keep away from oxidizing agents, strong bases, and sources of ignition. Regular inspection of containers is essential to prevent leaks.

What to do in case of contact with 1,4-dichlorobut-2-ene?

Immediate action is critical following contact with 1,4-dichlorobut-2-ene due to its corrosive and toxic nature. For skin contact, immediately remove contaminated clothing and flush affected area with copious amounts of water for at least 15 minutes. In case of eye contact, rinse thoroughly with water. If inhaled, move to fresh air immediately. Seek immediate medical attention in all cases and provide safety data sheet information to medical personnel.

How to dispose of 1,4-dichlorobut-2-ene appropriately?

1,4-dichlorobut-2-ene disposal must comply with strict hazardous waste regulations due to its carcinogenic and toxic properties. The substance requires disposal through licensed hazardous waste contractors capable of handling toxic and carcinogenic materials. Incineration at high temperatures in approved facilities is typically the preferred method. Never dispose of through regular waste streams or sewage systems. Consult local environmental authorities for specific requirements.

How to transport 1,4-dichlorobut-2-ene?

1,4-dichlorobut-2-ene is classified under ADR Class 6.1 (toxic substances), Packing Group II, indicating high toxicity requiring special transport precautions. Transport must comply with dangerous goods regulations, using approved packaging and labeling with appropriate hazard pictogrammes (GHS06, GHS05, GHS08, GHS09). Drivers require specialized dangerous goods training, and transport documentation must include proper shipping names and emergency response information.

Is 1,4-dichlorobut-2-ene subject to special regulations?

1,4-dichlorobut-2-ene is subject to extensive regulatory oversight under REACH, CLP, and national chemical safety regulations due to its Carc. 1B classification and high acute toxicity. Users must comply with worker protection regulations, environmental discharge limits, and potentially authorization requirements. The substance requires comprehensive risk assessments, exposure controls, and regulatory notifications. Regular monitoring and reporting may be mandatory depending on usage volumes and applications.

Where to buy 1,4-dichlorobut-2-ene in Europe?

1,4-dichlorobut-2-ene is available through OYSI, a specialized European distributor of technical chemicals with expertise in hazardous substances. Due to the substance's high toxicity and carcinogenic classification, procurement requires demonstration of appropriate handling capabilities, regulatory compliance, and legitimate industrial use. OYSI provides comprehensive documentation, safety data sheets, and technical support to ensure safe and compliant handling throughout the supply chain.

Data Sources

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