7-diethoxyphosphinothioyloxy-4-methylchromen-2-one
C14H17O5PS
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Identification
- CAS Number
- 299-45-6
- UN Number
- 2783
- Index Number
- 015-076-00-0
- PubChem CID
- 10496498
Physical-chemical properties
- Molecular Formula
- C14H17O5PS
- Molar Mass
- 328.32 g/mol
- IUPAC Name
- 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one
Chemical Identifiers
- InChI
- InChI=1S/C14H17O5PS/c1-4-16-20(21,17-5-2)19-11-6-7-12-10(3)8-14(15)18-13(12)9-11/h6-9H,4-5H2,1-3H3
- InChI Key
- KNIUHBNRWZGIQQ-UHFFFAOYSA-N
Overview
7-diethoxyphosphinothioyloxy-4-methylchromen-2-one (CAS 299-45-6) is an organophosphorus compound with high acute toxicity and environmental hazard properties. This specialized organophosphorus derivative combines a coumarin backbone with a phosphorothioate ester group, resulting in a compound with molecular formula C14H17O5PS and molecular weight of 328.32 g/mol. The substance belongs to the broader category of phosphorothioate esters, which are characterized by the presence of both phosphorus-sulfur and phosphorus-oxygen bonds within their molecular structure. The compound presents significant safety considerations due to its classification under multiple acute toxicity categories, including Acute Tox. 1 and Acute Tox. 2 classifications. The GHS06 skull and crossbones pictogram indicates severe toxicity risks, while the GHS09 environmental pictogram reflects its classification as Aquatic Acute 1 and Aquatic Chronic 1, signifying both immediate and long-term environmental hazards. Transportation regulations classify this material under ADR Class 6.1, designating it as a toxic substance requiring specialized handling and shipping protocols. The coumarin-phosphorothioate structure suggests potential applications in specialized chemical synthesis and research applications, particularly in the development of bioactive compounds or as intermediates in pharmaceutical chemistry. Industrial applications may include use as a synthetic intermediate in agrochemical production or in specialized analytical chemistry applications. Unlike simpler compounds such as formonitrile, this complex molecule requires sophisticated handling procedures and specialized storage conditions. Due to its high toxicity profile and environmental impact potential, this compound demands strict adherence to safety protocols including appropriate personal protective equipment, controlled storage conditions, and specialized waste disposal procedures. OYSI maintains availability of this technical-grade compound for qualified industrial and research customers with appropriate handling capabilities.
Safety & Classification
Acute Tox. 2 *; Acute Tox. 1; Acute Tox. 2 *; 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
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
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 | 2783 |
| ADR Class | 6.1 |
| Packing Group | II |
| Tunnel Code | D/E |
| Proper Shipping Name | Potasan, fest |
| Marine Pollutant | No |
Frequently Asked Questions
What is 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one?
7-diethoxyphosphinothioyloxy-4-methylchromen-2-one is an organophosphorus compound with the molecular formula C14H17O5PS and CAS number 299-45-6. This chemical substance has a molecular weight of 328.32 g/mol and belongs to the coumarin derivative family with phosphorothioate functionality. It is classified as a highly toxic substance with significant environmental hazards, requiring careful handling and specialized safety protocols in industrial applications.
What are the physicochemical properties of 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one?
7-diethoxyphosphinothioyloxy-4-methylchromen-2-one exhibits specific physicochemical characteristics typical of organophosphorus compounds. With its molecular formula C14H17O5PS and molecular weight of 328.32 g/mol, this compound contains both aromatic coumarin and phosphorothioate moieties. The exact physical state, color, odor, and solubility properties should be confirmed through technical documentation, as these parameters are critical for proper handling and application procedures.
What is 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one used for?
7-diethoxyphosphinothioyloxy-4-methylchromen-2-one serves as an important intermediate in specialized chemical synthesis and research applications. Given its organophosphorus structure and coumarin backbone, it is primarily utilized in pharmaceutical research, agrochemical development, and advanced organic synthesis processes. The compound's unique molecular structure makes it valuable for creating complex chemical derivatives and for specific analytical applications in laboratory settings.
How to handle 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one safely?
Safe handling of 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one requires strict safety protocols due to its Acute Tox. 1 and 2 classifications. Essential personal protective equipment includes chemical-resistant gloves, safety goggles, and respiratory protection. Work must be conducted in well-ventilated areas or under fume hoods. Avoid skin contact, inhalation, and ingestion. Emergency eyewash stations and safety showers should be readily accessible during handling operations.
How to store 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one correctly?
Proper storage of 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one requires secure, temperature-controlled conditions in designated chemical storage areas. The substance should be kept in original containers, away from incompatible materials and ignition sources. Storage areas must be well-ventilated, dry, and accessible only to trained personnel. Given its high toxicity classification, specific segregation requirements and emergency response procedures should be established for the storage location.
What to do in case of contact with 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one?
Immediate first aid measures for 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one exposure include thorough decontamination procedures. For skin contact, remove contaminated clothing and wash affected area with soap and water for at least 15 minutes. In case of eye contact, flush immediately with clean water for 15-20 minutes. If inhaled, move to fresh air immediately. Seek medical attention promptly for all exposure incidents due to the substance's high toxicity classification.
How to dispose of 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one appropriately?
Disposal of 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one must comply with local and European waste regulations for hazardous chemicals. The substance cannot be disposed of through regular waste streams due to its toxicity and environmental hazard classifications. Licensed hazardous waste disposal companies should handle collection and treatment. Contaminated materials, containers, and personal protective equipment require specialized disposal procedures following applicable environmental protection guidelines.
How to transport 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one?
Transportation of 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one is regulated under ADR classification 6.1 (toxic substances), Packing Group II. This classification requires specific packaging, labeling, and documentation requirements for road transport. Vehicles must display appropriate hazard placards, and drivers need specialized training certificates. Shipping documentation must include proper shipping names, hazard classes, and emergency response information according to dangerous goods transportation regulations.
Is 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one subject to specific regulations?
7-diethoxyphosphinothioyloxy-4-methylchromen-2-one is subject to comprehensive European chemical regulations including REACH registration requirements and CLP classification obligations. The substance is not currently identified as an SVHC (Substance of Very High Concern), but its high toxicity classification requires compliance with occupational safety regulations and environmental protection measures. Users must maintain safety data sheets and implement appropriate risk management measures according to regulatory requirements.
Where to buy 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one in Europe?
7-diethoxyphosphinothioyloxy-4-methylchromen-2-one is available through OYSI, a specialized European distributor of technical chemicals and research compounds. OYSI provides reliable supply chains for laboratory and industrial customers across Europe, ensuring proper documentation and regulatory compliance. For specific availability, quantities, and technical specifications, customers should contact OYSI directly to discuss their requirements and obtain detailed product information and safety documentation.
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ADR Consulting for 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one
7-diethoxyphosphinothioyloxy-4-methylchromen-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.