N,N-dimethyltrithian-5-amine;oxalic acid

C7H13NO4S3

CAS31895-22-4
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
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Identification

CAS Number
31895-22-4
EC Number
250-859-2
UN Number
2588
Index Number
607-170-00-0
PubChem CID
35969

Physical-chemical properties

Molecular Formula
C7H13NO4S3
Molar Mass
271.40 g/mol
IUPAC Name
N,N-dimethyltrithian-5-amine;oxalic acid

Chemical Identifiers

InChI
InChI=1S/C5H11NS3.C2H2O4/c1-6(2)5-3-7-9-8-4-5;3-1(4)2(5)6/h5H,3-4H2,1-2H3;(H,3,4)(H,5,6)
InChI Key
ICTQUFQQEYSGGJ-UHFFFAOYSA-N

Overview

N,N-dimethyltrithian-5-amine;oxalic acid (CAS 31895-22-4) is a sulfur-containing organic compound with dimethylamino functionality and oxalic acid association. This specialized chemical compound represents a unique combination of a trithiane ring system with tertiary amine functionality, stabilized as an oxalate salt. With the molecular formula C7H13NO4S3 and a molecular weight of 271.4 g/mol, this substance exhibits distinctive properties due to its multiple sulfur atoms and dimethylamino group configuration. The compound is classified under EC number 250-859-2 and falls within the European chemical regulatory framework for controlled substances. The safety profile of N,N-dimethyltrithian-5-amine;oxalic acid requires careful handling protocols, as indicated by its classification as Acute Tox. 4 and its significant aquatic toxicity ratings (Aquatic Acute 1; Aquatic Chronic 1). The compound displays GHS07 and GHS09 pictograms with a "Warning" signal word, emphasizing both human health concerns and environmental impact considerations. Transportation falls under ADR class 6.1, reflecting its toxic substance classification for shipping and logistics purposes. Industrial applications of this compound typically involve its use as an intermediate in organic synthesis, particularly in pharmaceutical and agrochemical manufacturing processes. The trithiane structure provides unique reactivity patterns that are valuable in specialized chemical transformations. It may also serve as a precursor in the synthesis of more complex sulfur-containing heterocycles, similar to how other specialized compounds like S-[3-carbamoylsulfanyl-2-(dimethylamino)propyl] carbamothioate;hydrochloride are utilized in pharmaceutical applications. OYSI maintains reliable supply chains for this technical-grade chemical compound, ensuring consistent availability for qualified industrial customers across European markets.

Safety & Classification

Warning
Classification:

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

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H312

Harmful in contact with skin.

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

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:

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 Number2588
ADR Class6.1
Packing GroupIII
Tunnel CodeE
Proper Shipping NameThiocyclam-oxalat (ISO)
Marine PollutantNo

Frequently Asked Questions

What is N,N-dimethyltrithian-5-amine;oxalic acid?

N,N-dimethyltrithian-5-amine;oxalic acid is a specialized chemical compound with CAS number 31895-22-4 and molecular formula C7H13NO4S3. This substance has a molecular weight of 271.4 g/mol and contains sulfur, nitrogen, and oxygen functional groups. It is classified as a moderately toxic compound requiring careful handling due to its acute toxicity properties and environmental hazards, particularly to aquatic life.

What are the physicochemical properties of N,N-dimethyltrithian-5-amine;oxalic acid?

N,N-dimethyltrithian-5-amine;oxalic acid is a complex organic compound with a molecular weight of 271.4 g/mol and the molecular formula C7H13NO4S3. The presence of three sulfur atoms, along with nitrogen and oxygen functionalities, gives this compound distinctive chemical characteristics. As an oxalic acid derivative combined with a dimethylated amine group, it exhibits properties typical of both acid and amine functionalities.

What is N,N-dimethyltrithian-5-amine;oxalic acid used for?

N,N-dimethyltrithian-5-amine;oxalic acid is used in specialized industrial and research applications where its unique sulfur-containing structure provides specific chemical properties. The compound's combination of amine and acid functionalities makes it suitable for various synthetic processes and chemical reactions. Its specific applications depend on the need for compounds with both nucleophilic and acidic characteristics in controlled industrial environments.

How to handle N,N-dimethyltrithian-5-amine;oxalic acid safely?

N,N-dimethyltrithian-5-amine;oxalic acid must be handled with appropriate personal protective equipment due to its Acute Tox. 4 classification and Warning signal word. Use chemical-resistant gloves, safety goggles, and protective clothing when handling this substance. Ensure adequate ventilation in work areas and avoid skin contact, inhalation, or ingestion. Handle in a controlled environment with proper safety protocols to prevent exposure to personnel and environmental contamination.

How to store N,N-dimethyltrithian-5-amine;oxalic acid correctly?

N,N-dimethyltrithian-5-amine;oxalic acid should be stored in a cool, dry, well-ventilated area away from incompatible materials. Keep containers tightly closed and properly labeled according to GHS requirements with GHS07 and GHS09 pictograms. Store away from heat sources, direct sunlight, and moisture. Due to its environmental hazard classification (Aquatic Acute 1, Aquatic Chronic 1), ensure secondary containment to prevent environmental release and groundwater contamination.

What to do in case of contact with N,N-dimethyltrithian-5-amine;oxalic acid?

In case of skin contact with N,N-dimethyltrithian-5-amine;oxalic acid, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water for at least 15 minutes. If inhaled, move to fresh air immediately. In case of eye contact, rinse thoroughly with water for at least 15 minutes. If ingested, do not induce vomiting and seek immediate medical attention. Always consult safety data sheets for specific first aid measures.

How to dispose of N,N-dimethyltrithian-5-amine;oxalic acid appropriately?

N,N-dimethyltrithian-5-amine;oxalic acid must be disposed of as hazardous waste through authorized waste management companies due to its toxicity and environmental hazard classifications. Never discharge this substance into sewers, waterways, or soil due to its Aquatic Acute 1 and Aquatic Chronic 1 classifications. Follow local and national regulations for hazardous waste disposal, and ensure proper documentation and tracking of waste disposal activities.

How to transport N,N-dimethyltrithian-5-amine;oxalic acid?

N,N-dimethyltrithian-5-amine;oxalic acid is classified under ADR Class 6.1 (Toxic substances) Packing Group III for transportation. This classification requires appropriate hazardous goods packaging, labeling, and documentation during transport. Vehicles must carry proper emergency equipment and drivers must have hazardous materials training. Ensure packages are properly marked with UN numbers and hazard labels before shipment according to dangerous goods regulations.

Is N,N-dimethyltrithian-5-amine;oxalic acid subject to particular regulations?

N,N-dimethyltrithian-5-amine;oxalic acid is subject to REACH registration requirements and CLP classification regulations in Europe. The substance is not currently listed as a Substance of Very High Concern (SVHC). However, its Acute Tox. 4 and aquatic toxicity classifications require compliance with chemical safety regulations, proper risk assessments, and safety data sheet provisions. Users must follow occupational exposure limits and environmental protection measures.

Where to buy N,N-dimethyltrithian-5-amine;oxalic acid in Europe?

N,N-dimethyltrithian-5-amine;oxalic acid is available through OYSI, a specialized European distributor of technical chemicals. OYSI provides this compound with proper documentation, safety data sheets, and regulatory compliance for industrial and research applications. As a professional chemical distributor, OYSI ensures quality standards and proper handling procedures for hazardous substances like this specialized sulfur-containing compound throughout European markets.

Data Sources

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