Diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane

C12H15N2O3PS

diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane

CAS13593-03-8
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
13593-03-8
EC Number
237-031-6
UN Number
2783
Index Number
015-138-00-7
PubChem CID
26124

Physical-chemical properties

Molecular Formula
C12H15N2O3PS
Molar Mass
298.30 g/mol
IUPAC Name
diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane

Chemical Identifiers

InChI
InChI=1S/C12H15N2O3PS/c1-3-15-18(19,16-4-2)17-12-9-13-10-7-5-6-8-11(10)14-12/h5-9H,3-4H2,1-2H3
InChI Key
JYQUHIFYBATCCY-UHFFFAOYSA-N

Overview

Diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane (CAS 13593-03-8) is an organophosphorus compound with quinoxaline functionality and notable biological activity properties. This specialized organophosphorus derivative represents a sophisticated molecular structure combining phosphorothioate chemistry with quinoxaline heterocyclic systems. With the molecular formula C12H15N2O3PS and a molecular weight of 298.3 g/mol, this compound exhibits unique chemical properties derived from its dual functional groups. The quinoxaline moiety provides aromatic stability and potential biological interactions, while the phosphorothioate group contributes to its reactivity profile and application versatility. The compound demonstrates significant toxicological properties, classified under multiple acute toxicity categories (Acute Tox. 3 and 4) requiring careful handling protocols. Its environmental impact classification as Aquatic Acute 1 and Aquatic Chronic 1 indicates substantial aquatic toxicity, necessitating strict containment measures during storage and use. The GHS06 and GHS09 pictograms reflect both its acute toxicity and environmental hazard potential, while the ADR Class 6.1 classification confirms its status as a toxic substance for transportation purposes. Primary industrial applications include specialized pharmaceutical intermediates and agrochemical synthesis, where its quinoxaline structure provides valuable building blocks for bioactive compounds. The compound also serves in advanced materials research and specialized organic synthesis applications. Related compounds such as 4-diethoxyphosphinothioyloxy-N,N-diethyl-6-methylpyrimidin-2-amine share similar phosphorothioate functionality, demonstrating the broader utility of this chemical class in various industrial sectors. OYSI maintains reliable supply chains for this specialized organophosphorus compound, ensuring consistent availability for qualified industrial customers requiring high-purity chemical intermediates.

Safety & Classification

Danger
Classification:

Acute Tox. 4 *; Acute Tox. 3 *; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H312

Harmful in contact with skin.

H301

Toxic 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

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 Number2783
ADR Class6.1
Packing GroupII
Tunnel CodeD/E
Proper Shipping NameQuinalphos (ISO), fest
Marine PollutantNo

Frequently Asked Questions

What is diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane?

Diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane is an organophosphorus compound with the molecular formula C12H15N2O3PS and a molecular weight of 298.3 g/mol. This chemical substance contains quinoxaline and phosphane structural elements, making it a specialized compound primarily used in industrial applications. It is classified as a hazardous substance under CLP regulation with acute toxicity and aquatic environmental hazards, requiring careful handling and storage procedures.

What are the physico-chemical properties of diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane?

Diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane is an organic compound with a molecular weight of 298.3 g/mol and the formula C12H15N2O3PS. As an organophosphorus compound containing quinoxaline groups, it typically exhibits moderate to low water solubility due to its organic nature. The compound contains ethoxy groups and sulfur-phosphorus bonds, which influence its chemical reactivity and stability. Specific physical properties like melting point, boiling point, and density require analytical determination.

What is diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane used for?

Diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane is primarily used in specialized industrial and research applications due to its organophosphorus and quinoxaline structure. Common applications include use as an intermediate in pharmaceutical synthesis, agricultural chemical production, or as a reagent in organic synthesis. The compound's unique molecular structure makes it valuable for developing specialized chemical products, particularly in industries requiring phosphorus-containing organic compounds with specific reactivity profiles.

How to handle diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane safely?

Diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane must be handled with appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing due to its Acute Tox. 4 and Acute Tox. 3 classifications. Work in well-ventilated areas or under fume hoods to prevent inhalation exposure. Avoid skin and eye contact, and ensure emergency wash facilities are readily available. Follow strict hygiene procedures, including thorough hand washing after handling, and never eat, drink, or smoke in work areas.

How to store diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane correctly?

Diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane should be stored in tightly sealed original containers in a cool, dry, well-ventilated area away from heat sources and direct sunlight. As an organophosphorus compound, store separately from oxidizing agents, strong acids, and bases to prevent incompatible reactions. Ensure storage areas are equipped with appropriate spill containment measures and are accessible only to trained personnel. Maintain storage temperatures as recommended by the manufacturer to preserve chemical stability and prevent degradation.

What to do in case of contact with diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane?

In case of skin contact with diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water for at least 15 minutes. For eye contact, flush immediately with clean water for 15 minutes while holding eyelids open. If inhaled, move the person to fresh air and seek medical attention if breathing difficulties occur. In case of ingestion, do not induce vomiting and seek immediate medical attention. Always consult the safety data sheet for specific first aid measures.

How to dispose of diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane appropriately?

Diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane must be disposed of as hazardous chemical waste through licensed waste management companies in accordance with local and European regulations. Due to its acute toxicity and aquatic hazard classifications, it cannot be discharged to sewers or waterways. Collect waste in appropriate containers, properly labeled with contents and hazard information. Contact specialized waste disposal services familiar with organophosphorus compounds. Small quantities may require specific treatment or incineration at authorized facilities equipped for hazardous chemical disposal.

How to transport diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane?

Diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane is classified under ADR Class 6.1 (Toxic substances), Packing Group II, indicating moderate toxicity during transport. Packages must be properly labeled with appropriate hazard labels and documentation must comply with ADR regulations. Use approved packaging materials suitable for toxic substances and ensure proper segregation from incompatible materials during transport. Carriers must be ADR-certified for transporting Class 6.1 substances, and emergency response information must accompany shipments throughout the European transport network.

Is diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane subject to specific regulations?

Diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane is subject to REACH regulation for registration and authorization within the EU, though it is not currently listed as a Substance of Very High Concern (SVHC). The compound falls under CLP regulation for classification, labeling, and packaging due to its acute toxicity and aquatic hazards. Companies handling this substance must comply with occupational health and safety regulations, environmental protection laws, and transport regulations (ADR) for hazardous materials across European markets.

Where to buy diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane in Europe?

Diethoxy-quinoxalin-2-yloxy-sulfanylidene-lambda5-phosphane is available through OYSI, a specialized European distributor of technical chemical products. OYSI provides this compound to industrial customers across Europe with proper regulatory documentation, safety data sheets, and technical support. As a professional chemical distributor, OYSI ensures compliance with REACH, CLP, and transport regulations while maintaining high quality standards. Contact OYSI directly for availability, specifications, and technical assistance for your specific industrial applications requiring this specialized organophosphorus compound.

Data Sources

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