2-chloroprop-2-enyl N,N-diethylcarbamodithioate

C8H14ClNS2

CAS95-06-7
GHS08 Gefahrensymbol: Gesundheitsgefahr – Gesundheitsgefahr
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
95-06-7
EC Number
202-388-9
UN Number
3082
Index Number
006-038-00-4
PubChem CID
7216

Physical-chemical properties

Molecular Formula
C8H14ClNS2
Molar Mass
223.80 g/mol
IUPAC Name
2-chloroprop-2-enyl N,N-diethylcarbamodithioate

Chemical Identifiers

InChI
InChI=1S/C8H14ClNS2/c1-4-10(5-2)8(11)12-6-7(3)9/h3-6H2,1-2H3
InChI Key
XJCLWVXTCRQIDI-UHFFFAOYSA-N

Overview

2-chloroprop-2-enyl N,N-diethylcarbamodithioate (CAS 95-06-7) is an organosulfur compound with carbamodithioate functionality and significant toxicological properties. This specialized chemical compound, also known by its IUPAC name 2-chloroprop-2-enyl N,N-diethylcarbamodithioate, represents a class of carbamodithioate derivatives with distinct structural characteristics. With the molecular formula C8H14ClNS2 and a molecular weight of 223.8 g/mol, this substance features both chlorinated allyl and diethylcarbamodithioate moieties, conferring unique chemical reactivity patterns. The compound is classified under multiple hazard categories, requiring careful handling protocols. It carries a Carc. 1B classification, indicating suspected carcinogenic properties, alongside Acute Tox. 4 designation for acute toxicity concerns. Environmental impact considerations are equally significant, with Aquatic Acute 1 and Aquatic Chronic 1 classifications highlighting potential ecological risks. These safety characteristics distinguish it from related compounds such as 4-[(4-amino-3-chlorophenyl)methyl]-2-chloroaniline, which presents different toxicological profiles. The substance falls under ADR Class 9 for transportation purposes, reflecting its miscellaneous dangerous goods classification. Proper safety equipment and ventilation systems are essential during handling, given the GHS08, GHS07, and GHS09 pictogram requirements indicating health, acute toxicity, and environmental hazards respectively. Industrial applications primarily center on specialized chemical synthesis processes where the carbamodithioate functionality provides specific reactivity patterns. The compound serves as an intermediate in certain pharmaceutical manufacturing routes and finds use in specialized polymer chemistry applications. Research applications also utilize this compound in studies involving sulfur-nitrogen bond chemistry. OYSI maintains availability of 2-chloroprop-2-enyl N,N-diethylcarbamodithioate for qualified industrial customers throughout Europe, ensuring proper regulatory compliance and safety documentation.

Safety & Classification

Danger
Classification:

Carc. 1B; Acute Tox. 4 *; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H350

May cause cancer.

H302

Harmful if swallowed.

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

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 Number3082
ADR Class9
Packing GroupIII
Tunnel Code-
Proper Shipping NameSulfallat (ISO)
Marine PollutantNo

Frequently Asked Questions

What is 2-chloroprop-2-enyl N,N-diethylcarbamodithioate?

2-chloroprop-2-enyl N,N-diethylcarbamodithioate is an organosulfur compound with the molecular formula C8H14ClNS2 and CAS number 95-06-7. This chemical substance has a molecular weight of 223.8 g/mol and belongs to the carbamodithioate family. It is classified as a Category 1B carcinogen and poses significant health and environmental hazards, requiring careful handling and specialized safety measures in industrial applications.

What are the physicochemical properties of 2-chloroprop-2-enyl N,N-diethylcarbamodithioate?

2-chloroprop-2-enyl N,N-diethylcarbamodithioate is a chemical compound with molecular formula C8H14ClNS2 and molecular weight of 223.8 g/mol. The substance contains chlorine, nitrogen, and sulfur atoms in its structure, giving it distinctive chemical properties. As an organosulfur compound, it typically exhibits limited water solubility and specific reactivity patterns. Detailed physical properties such as melting point, boiling point, and density should be verified from technical datasheets.

What is 2-chloroprop-2-enyl N,N-diethylcarbamodithioate used for?

2-chloroprop-2-enyl N,N-diethylcarbamodithioate is primarily used in specialized industrial applications requiring organosulfur chemistry. The compound's unique structure makes it valuable in chemical synthesis and manufacturing processes. However, due to its Category 1B carcinogen classification and high toxicity, its applications are strictly regulated and limited to professional use only. Industries using this substance must implement comprehensive safety protocols and ensure compliance with occupational health regulations.

How to handle 2-chloroprop-2-enyl N,N-diethylcarbamodithioate safely?

2-chloroprop-2-enyl N,N-diethylcarbamodithioate requires extreme caution during handling due to its carcinogenic and toxic properties. Essential personal protective equipment includes chemical-resistant gloves, protective clothing, respiratory protection, and eye protection. Work must be conducted in well-ventilated areas or under fume hoods. Avoid skin contact, inhalation, and ingestion. Implement strict hygiene measures, including thorough washing after handling and contaminated clothing removal before leaving work areas.

How to store 2-chloroprop-2-enyl N,N-diethylcarbamodithioate correctly?

2-chloroprop-2-enyl N,N-diethylcarbamodithioate 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 secured and accessible only to authorized personnel due to the substance's carcinogenic classification. Keep containers properly labeled and maintain appropriate spill containment measures. Regular inspection of storage conditions and container integrity is essential to prevent accidental release or exposure.

What to do in case of contact with 2-chloroprop-2-enyl N,N-diethylcarbamodithioate?

Immediate action is required following contact with 2-chloroprop-2-enyl N,N-diethylcarbamodithioate due to its high toxicity. For skin contact, remove contaminated clothing and wash affected area thoroughly with soap and water. In case of eye contact, rinse immediately with plenty of water for at least 15 minutes. If inhaled, move to fresh air immediately. For ingestion, do not induce vomiting. Seek immediate medical attention in all cases and provide safety data sheet to medical personnel.

How to dispose of 2-chloroprop-2-enyl N,N-diethylcarbamodithioate properly?

2-chloroprop-2-enyl N,N-diethylcarbamodithioate requires specialized hazardous waste disposal due to its carcinogenic properties and environmental toxicity. The substance cannot be disposed of through regular waste streams and must be handled by licensed hazardous waste disposal companies. Collection, transport, and treatment must comply with local and European waste regulations. Maintain proper documentation of disposal activities and ensure complete traceability throughout the waste management process.

How to transport 2-chloroprop-2-enyl N,N-diethylcarbamodithioate?

2-chloroprop-2-enyl N,N-diethylcarbamodithioate is classified as ADR Class 9 (Miscellaneous Dangerous Substances), Packing Group III for transport purposes. Transportation must comply with ADR regulations including proper packaging, labeling, and documentation requirements. Vehicles must carry appropriate safety equipment and emergency response information. Only certified carriers experienced in handling hazardous materials should transport this substance, ensuring compliance with all applicable transport regulations and safety protocols.

Is 2-chloroprop-2-enyl N,N-diethylcarbamodithioate subject to specific regulations?

2-chloroprop-2-enyl N,N-diethylcarbamodithioate is subject to comprehensive European chemical regulations under REACH and CLP frameworks. The substance carries GHS pictograms GHS08, GHS07, and GHS09, indicating serious health and environmental hazards. Its carcinogenic classification (Carc. 1B) triggers strict occupational exposure limits and workplace controls. Users must maintain safety data sheets, implement risk management measures, and comply with notification requirements for industrial use and worker protection.

Where to buy 2-chloroprop-2-enyl N,N-diethylcarbamodithioate in Europe?

2-chloroprop-2-enyl N,N-diethylcarbamodithioate is available through specialized chemical distributors in Europe, including OYSI, which serves as a reliable European supplier for industrial chemicals. Due to the substance's hazardous classification and regulatory requirements, procurement is limited to qualified industrial users with appropriate handling facilities and safety protocols. Suppliers must verify customer credentials and intended use before supply, ensuring compliance with all applicable regulations and safety requirements.

Data Sources

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