6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one
C10H6N2OS2
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Identification
- CAS Number
- 2439-01-2
- EC Number
- 219-455-3
- UN Number
- 2588
- Index Number
- 606-036-00-9
- PubChem CID
- 17109
Physical-chemical properties
- Molecular Formula
- C10H6N2OS2
- Molar Mass
- 234.30 g/mol
- IUPAC Name
- 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one
Chemical Identifiers
- InChI
- InChI=1S/C10H6N2OS2/c1-5-2-3-6-7(4-5)12-9-8(11-6)14-10(13)15-9/h2-4H,1H3
- InChI Key
- FBQQHUGEACOBDN-UHFFFAOYSA-N
Overview
6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one (CAS 2439-01-2) is a heterocyclic sulfur-nitrogen compound with dithiolo-quinoxaline core structure and notable biological activity. This specialized organic compound, with molecular formula C10H6N2OS2 and molecular weight 234.3 g/mol, belongs to the quinoxaline derivative family featuring a unique dithiolo ring system. The EC number 219-455-3 identifies this substance within European chemical regulations. Its complex heterocyclic structure incorporates both sulfur and nitrogen atoms, contributing to its distinctive chemical properties and reactivity profile. Safety considerations are paramount when handling this compound, as it carries multiple hazard classifications including reproductive toxicity (Repr. 2), acute toxicity (Acute Tox. 4), specific target organ toxicity (STOT RE 2), eye irritation (Eye Irrit. 2), and skin sensitization (Skin Sens. 1). The presence of GHS08, GHS07, and GHS09 pictograms with "Warning" signal word indicates the need for appropriate personal protective equipment and controlled handling procedures. Transport classification under ADR Class 6.1 reflects its toxic nature requiring specialized logistics. Industrial applications of 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one primarily focus on pharmaceutical intermediates and specialty chemical synthesis, where its quinoxaline framework serves as a valuable building block. The compound also finds use in materials science research, particularly in developing organic semiconductors and advanced polymer systems. Unlike simpler aromatic compounds such as 4-aminophenol, this dithiolo-quinoxaline derivative offers unique electronic properties due to its extended conjugated system. OYSI provides reliable access to 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one for qualified industrial customers across Europe, ensuring compliance with all relevant safety and regulatory requirements.
Safety & Classification
Repr. 2; Acute Tox. 4 *; Acute Tox. 4 *; Acute Tox. 4 *; STOT RE 2 *; Eye Irrit. 2; Skin Sens. 1;...
GHS Pictograms
HHazard Statements (H-Statements)
Describe the nature and severity of the hazard
Harmful if inhaled.
Harmful in contact with skin.
Harmful if swallowed.
May cause damage to organs through prolonged or repeated exposure.
Causes serious eye irritation.
May cause an allergic skin reaction.
Very toxic to aquatic life.
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
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
Measures if substance contacts the skin
Eye Contact
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
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 | 2588 |
| ADR Class | 6.1 |
| Packing Group | III |
| Tunnel Code | E |
| Proper Shipping Name | Chinomethionat (ISO) |
| Marine Pollutant | No |
Frequently Asked Questions
What is 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one?
6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one is a heterocyclic organic compound with the molecular formula C10H6N2OS2 and CAS number 2439-01-2. This quinoxaline derivative contains sulfur and nitrogen heteroatoms in its fused ring system, with a molecular weight of 234.3 g/mol. It belongs to the dithioloquinoxaline family of compounds, characterized by its unique structural arrangement combining quinoxaline and dithiole ring systems with a methyl substituent at position 6.
What are the physicochemical properties of 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one?
6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one is a solid organic compound at room temperature with a molecular weight of 234.3 g/mol. The compound features a complex heterocyclic structure containing both sulfur and nitrogen atoms within fused ring systems. As a quinoxaline derivative with dithiole moieties, it likely exhibits limited water solubility due to its aromatic nature. The presence of sulfur atoms may contribute to specific optical and electronic properties characteristic of organosulfur compounds.
What is 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one used for?
6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one is primarily used as a chemical intermediate and research compound in organic synthesis applications. Its unique heterocyclic structure makes it valuable for pharmaceutical research, materials science, and specialty chemical manufacturing. The compound may serve as a building block for developing more complex molecules or as a reference standard in analytical chemistry. Due to its specialized nature, it is typically employed in professional laboratory settings and industrial research environments.
How to handle 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one safely?
6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one requires careful handling due to its classification as Acute Tox. 4, Eye Irrit. 2, and Skin Sens. 1. Essential personal protective equipment includes chemical-resistant gloves, safety goggles, and protective clothing. Work in well-ventilated areas or use fume hoods to prevent inhalation exposure. Avoid skin and eye contact, and never eat, drink, or smoke while handling. Wash hands thoroughly after use and ensure emergency eyewash stations are accessible.
How to store 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one correctly?
6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one should be stored in a cool, dry, well-ventilated area away from heat sources and direct sunlight. Keep containers tightly sealed to prevent moisture absorption and contamination. Store in original labeled containers in a designated chemical storage area with appropriate secondary containment. Due to its toxicity classification, maintain separation from food, beverages, and incompatible materials. Ensure storage areas have adequate temperature control and access restrictions for authorized personnel only.
What to do in case of contact with 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one?
In case of skin contact with 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one, immediately wash affected area with soap and plenty of water for at least 15 minutes. For eye contact, flush eyes with clean water for 15 minutes, holding eyelids open. If inhaled, move person to fresh air and monitor breathing. Remove contaminated clothing and wash before reuse. Seek immediate medical attention for all exposure routes, especially given the compound's acute toxicity classification. Keep the safety data sheet available for medical personnel.
How to dispose of 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one properly?
6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one must be disposed of as hazardous chemical waste due to its toxicity classification and environmental concerns indicated by GHS09 pictogram. Contact licensed hazardous waste disposal companies for proper collection and treatment. Never dispose of in regular trash, sewers, or drains. Collect waste in appropriate, labeled containers and maintain disposal records. Follow local, national, and EU waste regulations including the Waste Framework Directive. Consider waste minimization strategies and recycling options where technically feasible.
How to transport 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one?
6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one is classified as ADR Class 6.1 (toxic substances), Packing Group III for transportation purposes. This classification requires specific packaging, labeling, and documentation according to dangerous goods regulations. Use UN-approved packaging with proper hazard labels and transport documents. Vehicles must carry appropriate emergency equipment and drivers need ADR certification. Ensure compliance with European Agreement concerning International Carriage of Dangerous Goods by Road (ADR) requirements for safe transport across European borders.
Is 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one subject to specific regulations?
6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one is subject to REACH regulation requiring registration for import/manufacture above one tonne annually. The compound is classified under CLP regulation with multiple hazard categories (Repr. 2, Acute Tox. 4, STOT RE 2, Eye Irrit. 2, Skin Sens. 1). It is not currently listed as a Substance of Very High Concern (SVHC). Users must comply with safety data sheet requirements, workplace exposure limits, and proper risk assessment procedures under EU chemical legislation.
Where to buy 6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one in Europe?
6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one is available through OYSI, a European distributor of specialty chemicals serving professional and industrial customers across Europe. OYSI provides comprehensive technical support, regulatory compliance documentation, and reliable supply chain management for this specialized compound. Contact OYSI directly for product availability, specifications, packaging options, and delivery to your location. As a professional chemical distributor, OYSI ensures proper handling, storage, and transportation according to European regulations and safety standards.
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6-methyl-[1,3]dithiolo[4,5-b]quinoxalin-2-one is a dangerous good. We support you with labeling, packaging, and transport documentation.
Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.