2-chloroethyl(trimethyl)azanium chloride
C5H13Cl2N
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Identification
- CAS Number
- 999-81-5
- EC Number
- 213-666-4
- UN Number
- 2761
- Index Number
- 007-003-00-6
- PubChem CID
- 13836
Physical-chemical properties
- Molecular Formula
- C5H13Cl2N
- Molar Mass
- 158.07 g/mol
- IUPAC Name
- 2-chloroethyl(trimethyl)azanium chloride
Chemical Identifiers
- InChI
- InChI=1S/C5H13ClN.ClH/c1-7(2,3)5-4-6;/h4-5H2,1-3H3;1H/q+1;/p-1
- InChI Key
- UHZZMRAGKVHANO-UHFFFAOYSA-M
Overview
2-chloroethyl(trimethyl)azanium chloride (CAS 999-81-5) is a quaternary ammonium chloride compound with chloroalkyl functionality and moderate acute toxicity properties. This specialized chemical compound, also known by its IUPAC designation 2-chloroethyl(trimethyl)azanium chloride, represents an important class of quaternary ammonium salts featuring a reactive chloroethyl substituent. With the molecular formula C5H13Cl2N and a molecular weight of 158.07 g/mol, this compound combines the characteristic properties of quaternary ammonium compounds with the reactivity of an alkyl chloride functional group. The compound exhibits moderate toxicity profiles, classified under GHS hazard class Acute Tox. 4 with Warning signal word and GHS07 pictogram, requiring appropriate handling precautions in industrial applications. Its ADR classification of 6.1 indicates it falls under toxic substances for transportation purposes. The dual chloride structure - featuring both an ionic chloride counterion and a covalently bound chloroethyl group - provides unique chemical reactivity patterns that distinguish it from simpler quaternary ammonium compounds. In industrial applications, 2-chloroethyl(trimethyl)azanium chloride serves primarily as a chemical intermediate in organic synthesis, particularly in the preparation of specialized surfactants and pharmaceutical intermediates. Its quaternary ammonium structure makes it valuable in antimicrobial formulations, while the reactive chloroethyl group enables further chemical modifications. The compound also finds application in polymer chemistry as a functionalization agent, where its dual reactive nature allows for controlled chemical modifications. Unlike related compounds such as benzonitrile or organophosphorus compounds like 2-dimethoxyphosphinothioylsulfanyl-N-ethylacetamide, this quaternary ammonium derivative offers unique solubility characteristics and reactivity profiles suitable for aqueous-based synthetic processes. OYSI provides reliable supply of 2-chloroethyl(trimethyl)azanium chloride to European industrial customers, supporting diverse chemical manufacturing applications with consistent quality standards.
Safety & Classification
Acute Tox. 4 *; Acute Tox. 4 *
GHS Pictograms
HHazard Statements (H-Statements)
Describe the nature and severity of the hazard
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
Skin Contact
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:
Ingestion
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 Number | 2761 |
| ADR Class | 6.1 |
| Packing Group | III |
| Tunnel Code | E |
| Proper Shipping Name | Chlormequatchlorid (ISO) |
| Marine Pollutant | No |
Frequently Asked Questions
What is 2-chloroethyl(trimethyl)azanium chloride?
2-chloroethyl(trimethyl)azanium chloride is a quaternary ammonium compound with the molecular formula C5H13Cl2N and CAS number 999-81-5. This chemical has a molecular weight of 158.07 g/mol and belongs to the class of chlorinated organic nitrogen compounds. It is classified as acutely toxic (Category 4) and requires careful handling due to its hazardous properties, displaying the GHS07 warning pictogram.
What are the physicochemical properties of 2-chloroethyl(trimethyl)azanium chloride?
2-chloroethyl(trimethyl)azanium chloride is a solid quaternary ammonium salt at room temperature. As an ionic compound containing chloride ions, it is typically highly soluble in water and polar solvents. The compound appears as a white to off-white crystalline powder under normal conditions. Its quaternary ammonium structure makes it stable under standard storage conditions while maintaining its ionic characteristics.
What is 2-chloroethyl(trimethyl)azanium chloride used for?
2-chloroethyl(trimethyl)azanium chloride is primarily used as a chemical intermediate in organic synthesis and pharmaceutical manufacturing. Its quaternary ammonium structure makes it valuable in the production of specialized compounds requiring cationic nitrogen functionalities. The compound serves as a building block in medicinal chemistry and may be utilized in research applications involving quaternary ammonium derivatives and related chemical transformations.
How to handle 2-chloroethyl(trimethyl)azanium chloride safely?
2-chloroethyl(trimethyl)azanium chloride requires careful handling due to its Acute Tox. 4 classification. Essential personal protective equipment includes chemical-resistant gloves, safety goggles, and lab coats. Work in well-ventilated areas or under fume hoods to minimize exposure. Avoid skin contact, inhalation, and ingestion. Wash hands thoroughly after handling and ensure emergency eyewash and shower facilities are accessible in the work area.
How to store 2-chloroethyl(trimethyl)azanium chloride correctly?
2-chloroethyl(trimethyl)azanium chloride should be stored in tightly sealed containers in a cool, dry place away from direct sunlight and heat sources. Keep containers in a well-ventilated storage area with appropriate temperature control. Store away from incompatible materials such as strong oxidizing agents. Ensure proper labeling with hazard information and maintain inventory records. Access should be restricted to trained personnel only.
What to do in case of contact with 2-chloroethyl(trimethyl)azanium chloride?
In case of skin contact with 2-chloroethyl(trimethyl)azanium chloride, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water for at least 15 minutes. For eye contact, flush eyes with clean water for 15 minutes while holding eyelids open. If inhaled, move to fresh air immediately. In case of ingestion, do not induce vomiting and seek immediate medical attention. Always consult a physician after exposure incidents.
How to dispose of 2-chloroethyl(trimethyl)azanium chloride appropriately?
2-chloroethyl(trimethyl)azanium chloride must be disposed of as hazardous chemical waste according to local and national regulations. Contact licensed waste disposal companies specialized in handling toxic chemicals. Never dispose of this substance in regular trash, sewers, or waterways. Small laboratory quantities should be collected in appropriate waste containers and labeled clearly. Consult local environmental authorities for specific disposal requirements and authorized disposal facilities.
How to transport 2-chloroethyl(trimethyl)azanium chloride?
2-chloroethyl(trimethyl)azanium chloride is classified under ADR Class 6.1 (toxic substances), Packing Group III for transportation purposes. Packages must be properly labeled with appropriate hazard labels and documentation. Use UN-approved packaging suitable for Class 6.1 materials. Transport vehicles must comply with ADR regulations for toxic substances. Ensure proper shipping papers, emergency response information, and trained personnel are involved in the transportation process.
Is 2-chloroethyl(trimethyl)azanium chloride subject to specific regulations?
2-chloroethyl(trimethyl)azanium chloride is subject to various chemical regulations including REACH registration requirements in Europe and CLP classification for hazard communication. The substance is not currently listed as a Substance of Very High Concern (SVHC). Companies must comply with safety data sheet requirements, proper labeling according to GHS standards, and workplace exposure limits where applicable. Regular regulatory updates should be monitored for any changes.
Where to buy 2-chloroethyl(trimethyl)azanium chloride in Europe?
2-chloroethyl(trimethyl)azanium chloride is available through OYSI, a specialized European distributor of technical chemicals. OYSI provides this compound to qualified industrial and research customers across Europe with proper documentation and regulatory compliance. Contact OYSI directly for availability, specifications, and pricing information. Purchases require appropriate business credentials and compliance with applicable regulations for handling toxic chemicals.
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Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.