N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide
C10H14N2O5S3
Consulting for N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide
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Identification
- CAS Number
- 120298-38-6
- EC Number
- 415-030-3
- UN Number
- 3077
- Index Number
- 616-103-00-4
- PubChem CID
- 21057026
Physical-chemical properties
- Molecular Formula
- C10H14N2O5S3
- Molar Mass
- 338.40 g/mol
- IUPAC Name
- N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide
Chemical Identifiers
- InChI
- InChI=1S/C10H14N2O5S3/c1-5-3-8(12-6(2)13)7-4-9(20(11,16)17)18-10(7)19(5,14)15/h4-5,8H,3H2,1-2H3,(H,12,13)(H2,11,16,17)
- InChI Key
- MQRCTNZVQVRCRD-UHFFFAOYSA-N
Overview
N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide (CAS 120298-38-6) is a specialized thieno[2,3-b]thiopyran derivative with notable sulfonamide functionality and acetamide substitution. This complex heterocyclic compound features a distinctive fused ring system combining thiophene and thiopyran structures, enhanced with multiple functional groups including sulfonamide and acetamide moieties. With the molecular formula C10H14N2O5S3 and molecular weight of 338.4 g/mol, this substance demonstrates significant structural complexity typical of advanced pharmaceutical intermediates and specialty chemical applications. The compound exhibits important safety considerations, classified as a skin sensitizer (Skin Sens. 1) requiring careful handling protocols in industrial environments. Its aquatic toxicity profile (Aquatic Acute 1; Aquatic Chronic 1) necessitates stringent environmental protection measures during manufacturing and disposal processes. The substance carries Warning signal word designation with GHS07 and GHS09 pictograms, indicating both health hazards and environmental concerns. Transportation falls under ADR Class 9, categorizing it as a miscellaneous dangerous substance. Key applications include pharmaceutical intermediate synthesis, where its unique thieno[2,3-b]thiopyran scaffold serves as a valuable building block for drug development. The compound also finds utility in agrochemical manufacturing and specialty polymer synthesis, where its multiple reactive sites enable diverse chemical transformations. Unlike simpler heterocyclic compounds such as 4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine, this molecule offers enhanced structural diversity for complex synthetic applications. Industrial applications typically involve controlled synthesis environments due to its sensitization potential and environmental impact profile. The sulfonamide functionality provides opportunities for further derivatization in medicinal chemistry applications. OYSI provides this specialized chemical intermediate to qualified industrial customers throughout Europe, supporting advanced chemical manufacturing and research applications.
Safety & Classification
Skin Sens. 1; Aquatic Acute 1; Aquatic Chronic 1
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:
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 | 3077 |
| ADR Class | 9 |
| Packing Group | III |
| Tunnel Code | - |
| Proper Shipping Name | (S,S)-trans-4-(Acetylamino)-5,6-dihydro-6-methyl-7,7-dioxo-4H-thieno[2,3-b]thiopyran-2-sulfonamid |
| Marine Pollutant | No |
Frequently Asked Questions
What is N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide?
N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide is a complex organic compound with molecular formula C10H14N2O5S3 and molecular weight 338.4 g/mol. This sulfur-containing heterocyclic compound features a thieno-thiopyran ring system with acetamide and sulfamoyl functional groups. It is classified as a skin sensitizer and poses environmental hazards to aquatic life, requiring careful handling and appropriate safety measures.
What are the physicochemical properties of N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide?
N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide has a molecular weight of 338.4 g/mol and contains three sulfur atoms in its structure. The compound features multiple polar functional groups including acetamide and sulfamoyl groups, which influence its solubility characteristics. As a complex heterocyclic compound, its physical state, color, and odor properties should be verified through technical specifications from the supplier.
What is N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide used for?
N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide is typically used as a pharmaceutical intermediate or research chemical in specialized applications. Its complex heterocyclic structure containing sulfamoyl groups suggests potential use in pharmaceutical synthesis or as a building block for bioactive compounds. The specific applications depend on the intended synthetic pathway and should be confirmed with technical documentation from qualified suppliers.
How to safely handle N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide?
Safe handling requires appropriate personal protective equipment due to its Skin Sens. 1 classification. Wear protective gloves, safety goggles, and protective clothing to prevent skin contact. Ensure adequate ventilation when working with this compound. Avoid generating dust or aerosols. Wash hands thoroughly after handling and remove contaminated clothing immediately. Work in well-ventilated areas and consider using fume hoods for operations involving powder handling or weighing.
How to properly store N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide?
Store this compound in tightly sealed containers in a cool, dry, well-ventilated area away from incompatible materials. Keep containers closed when not in use and protect from moisture and heat. Due to its environmental hazard classification (Aquatic Acute 1, Aquatic Chronic 1), ensure secure storage to prevent environmental release. Store away from oxidizing agents and other reactive chemicals. Maintain proper labeling and inventory records according to chemical storage regulations.
What to do in case of contact with N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide?
In case of skin contact, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water for at least 15 minutes due to its skin sensitization potential. For eye contact, flush immediately with clean water for 15 minutes. If inhaled, move to fresh air immediately. Seek medical attention if irritation persists or sensitization symptoms develop. Do not induce vomiting if accidentally ingested - seek immediate medical attention.
How to properly dispose of N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide?
Disposal must comply with local, national, and international environmental regulations due to its Aquatic Acute 1 and Aquatic Chronic 1 classifications. Never discharge to sewers or waterways. Contact authorized hazardous waste disposal companies for proper treatment and disposal. Incineration at appropriate temperature in licensed facilities may be suitable. Empty containers should be triple-rinsed and disposed of according to local regulations. Maintain disposal records for regulatory compliance.
How to transport N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide?
This compound is classified as ADR Class 9 (Miscellaneous dangerous goods), Packing Group III, indicating moderate transport hazard. Use appropriate UN-specification packaging and ensure proper labeling with GHS07 and GHS09 pictogrammes. Transport documentation must include proper shipping name, UN number, and hazard class. Vehicles must comply with ADR requirements for Class 9 substances. Avoid transport during extreme weather conditions and ensure emergency response information is available.
Is N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide subject to special regulations?
This compound is subject to CLP regulation for classification and labeling (Skin Sens. 1, Aquatic Acute 1, Aquatic Chronic 1) and requires appropriate hazard communication. It falls under REACH regulation for registration and authorization within the EU. While not currently listed as SVHC, its environmental hazard profile requires compliance with environmental protection regulations. Users must maintain safety data sheets and ensure proper risk assessment and management measures are implemented.
Where to buy N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide in Europe?
OYSI serves as a reliable European distributor for this specialized compound, offering professional chemical supply services across Europe. As an established chemical distributor, OYSI provides proper documentation, safety data sheets, and regulatory compliance support. Contact OYSI directly for availability, specifications, and technical support. Their expertise in chemical distribution ensures proper handling, packaging, and delivery of this regulated compound while maintaining full regulatory compliance throughout the European market.
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SDS Service
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Technical Consulting
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REACH Safety Data Sheet
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Digital Product Passport
EU-compliant product documentation
ADR Consulting for N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide
N-(6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl)acetamide 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.