4,5-dichloro-2-octyl-1,2-thiazol-3-one

C11H17Cl2NOS

CAS64359-81-5
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GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
64359-81-5
EC Number
264-843-8
UN Number
2928
Index Number
613-335-00-8
PubChem CID
91688

Physical-chemical properties

Molecular Formula
C11H17Cl2NOS
Molar Mass
282.20 g/mol
IUPAC Name
4,5-dichloro-2-octyl-1,2-thiazol-3-one

Chemical Identifiers

InChI
InChI=1S/C11H17Cl2NOS/c1-2-3-4-5-6-7-8-14-11(15)9(12)10(13)16-14/h2-8H2,1H3
InChI Key
PORQOHRXAJJKGK-UHFFFAOYSA-N

Overview

4,5-dichloro-2-octyl-1,2-thiazol-3-one (CAS 64359-81-5) is an organosulfur heterocyclic compound with potent biocidal properties and significant toxicity hazards. This chlorinated thiazole derivative represents a specialized chemical intermediate widely utilized in industrial preservation applications. With its molecular formula C11H17Cl2NOS and molecular weight of 282.2 g/mol, the compound features a five-membered thiazole ring system substituted with two chlorine atoms and an octyl chain, conferring both antimicrobial efficacy and lipophilic characteristics. The European Chemical Agency has assigned it EC number 264-843-8, reflecting its regulated status under REACH legislation. The substance presents substantial safety considerations, classified under multiple hazard categories including acute toxicity (categories 2 and 4), severe skin corrosion, serious eye damage, and strong skin sensitization potential. Its aquatic toxicity profile necessitates careful environmental management protocols. Transport regulations classify it under ADR class 6.1 as a toxic substance, requiring specialized handling procedures and appropriate packaging standards. Primary industrial applications include formulation of preservation systems for water-based products, antimicrobial treatment solutions, and specialized coating formulations where broad-spectrum biocidal activity is essential. Unlike simpler biocides such as 2,2-dibromo-2-cyanoacetamide, this thiazole compound offers enhanced stability and prolonged antimicrobial effectiveness in challenging pH environments. The compound's structural complexity and regulatory requirements demand expertise in safe handling protocols and appropriate personal protective equipment. Storage conditions must account for its corrosive nature and environmental sensitivity. OYSI maintains availability of 4,5-dichloro-2-octyl-1,2-thiazol-3-one through our European distribution network, supporting customers with comprehensive technical documentation and regulatory compliance assistance.

Safety & Classification

Danger
Classification:

Acute Tox. 2; Acute Tox. 4; Skin Corr. 1; Eye Dam. 1; Skin Sens. 1A; Aquatic Acute 1; Aquatic Chr...

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H330

Fatal if inhaled.

H302

Harmful if swallowed.

H314

Causes severe skin burns and eye damage.

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

Harmful

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

Harmful

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 Number2928
ADR Class6.1
Packing GroupII
Tunnel CodeD/E
Proper Shipping Name4,5-Dichlor-2-octyl-2H-isothiazol-3-on, fest
Marine PollutantNo

Frequently Asked Questions

What is 4,5-dichloro-2-octyl-1,2-thiazol-3-one?

4,5-dichloro-2-octyl-1,2-thiazol-3-one is a chlorinated thiazole derivative with the molecular formula C11H17Cl2NOS and CAS number 64359-81-5. This organic compound has a molecular weight of 282.2 g/mol and contains two chlorine atoms attached to a thiazole ring with an octyl side chain. It is classified as a hazardous substance with multiple toxicity concerns including acute toxicity, skin corrosion, and environmental hazards.

What are the physicochemical properties of 4,5-dichloro-2-octyl-1,2-thiazol-3-one?

4,5-dichloro-2-octyl-1,2-thiazol-3-one is an organic compound with a molecular weight of 282.2 g/mol and molecular formula C11H17Cl2NOS. As a chlorinated thiazole derivative with an octyl chain, it likely exhibits low water solubility due to its hydrophobic alkyl group, while being soluble in organic solvents. The specific physical properties such as melting point, boiling point, and exact appearance may vary depending on purity and formulation.

What is 4,5-dichloro-2-octyl-1,2-thiazol-3-one used for?

4,5-dichloro-2-octyl-1,2-thiazol-3-one is primarily used as a biocide and preservative in industrial applications. Its thiazole structure with chlorine substituents provides antimicrobial properties, making it effective against bacteria, fungi, and algae. Common applications include preservation of paints, coatings, adhesives, metalworking fluids, and other industrial formulations where microbial control is essential. It may also be used in water treatment systems and as a material preservative.

How to handle 4,5-dichloro-2-octyl-1,2-thiazol-3-one safely?

4,5-dichloro-2-octyl-1,2-thiazol-3-one requires strict safety measures due to its corrosive and toxic properties. Essential PPE includes chemical-resistant gloves, safety goggles, and protective clothing to prevent skin and eye contact. Work in well-ventilated areas or use respiratory protection to avoid inhalation. Handle with care as it causes severe skin burns, eye damage, and may cause allergic skin reactions. Always have emergency eyewash and shower facilities available.

How to store 4,5-dichloro-2-octyl-1,2-thiazol-3-one correctly?

4,5-dichloro-2-octyl-1,2-thiazol-3-one must be stored in tightly sealed, corrosion-resistant containers in a cool, dry, well-ventilated area away from heat sources and incompatible materials. Keep away from strong bases, oxidizing agents, and reactive metals due to its corrosive nature. Store separately from food, feed, and drinking water. Ensure storage areas have appropriate spill containment and are accessible only to trained personnel wearing proper protective equipment.

What to do in case of contact with 4,5-dichloro-2-octyl-1,2-thiazol-3-one?

Immediate action is critical due to the corrosive nature of 4,5-dichloro-2-octyl-1,2-thiazol-3-one. For skin contact, immediately remove contaminated clothing and rinse affected area with plenty of water for at least 15 minutes. For eye contact, flush immediately with water for at least 15 minutes and remove contact lenses if present. If inhaled, move to fresh air immediately. Seek immediate medical attention in all cases of exposure and never induce vomiting if ingested.

How to dispose of 4,5-dichloro-2-octyl-1,2-thiazol-3-one appropriately?

4,5-dichloro-2-octyl-1,2-thiazol-3-one must be disposed of as hazardous waste through licensed waste management companies. Due to its toxic and environmentally hazardous classification, it cannot be disposed of in normal waste streams or sewers. Treatment typically involves high-temperature incineration at authorized facilities. Always consult local environmental regulations and waste management authorities for specific disposal requirements, as regulations may vary by jurisdiction within Europe.

How to transport 4,5-dichloro-2-octyl-1,2-thiazol-3-one?

4,5-dichloro-2-octyl-1,2-thiazol-3-one is classified under ADR as Class 6.1 (Toxic substances), Packing Group II, indicating significant toxicity requiring special transport precautions. Shipments must comply with ADR regulations including proper packaging, labeling with appropriate hazard labels, and accompanying transport documents. Only trained personnel should handle the transport, and vehicles must carry appropriate emergency equipment. Professional logistics companies experienced in hazardous materials transport should be used.

Is 4,5-dichloro-2-octyl-1,2-thiazol-3-one subject to particular regulations?

4,5-dichloro-2-octyl-1,2-thiazol-3-one is subject to multiple European chemical regulations including REACH registration requirements and CLP classification as a hazardous substance. While not currently listed as an SVHC (Substance of Very High Concern), its toxic and environmentally hazardous properties may trigger additional restrictions. Users must comply with occupational safety regulations, environmental protection laws, and biocide regulations if used as a preservative. Regular regulatory monitoring is essential as classifications may change.

Where to buy 4,5-dichloro-2-octyl-1,2-thiazol-3-one in Europe?

4,5-dichloro-2-octyl-1,2-thiazol-3-one is available through OYSI, a European distributor specializing in technical chemicals. As a professional-grade hazardous substance, it is typically supplied only to qualified industrial users with proper handling capabilities and regulatory compliance. Purchase requires appropriate documentation including safety data sheets and may involve quantity restrictions. Contact OYSI directly for availability, technical specifications, and regulatory compliance support for your specific application requirements.

Data Sources

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