6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one
C12H15ClNO4PS2
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Identification
- CAS Number
- 2310-17-0
- EC Number
- 218-996-2
- UN Number
- 2783
- Index Number
- 015-067-00-1
- PubChem CID
- 4793
Physical-chemical properties
- Molecular Formula
- C12H15ClNO4PS2
- Molar Mass
- 367.80 g/mol
- IUPAC Name
- 6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one
Chemical Identifiers
- InChI
- InChI=1S/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3
- InChI Key
- IOUNQDKNJZEDEP-UHFFFAOYSA-N
Overview
6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one (CAS 2310-17-0) is an organophosphorus compound featuring benzoxazolone structure with notable pesticidal properties. This specialized chemical compound represents a sophisticated organophosphorus derivative that combines benzoxazolone heterocyclic framework with phosphorothioate functionality. With its molecular formula C12H15ClNO4PS2 and molecular weight of 367.8 g/mol, this substance exhibits unique structural characteristics that make it valuable for specific industrial applications requiring both the stability of the benzoxazolone ring system and the biological activity associated with organophosphorus compounds. The compound carries significant safety considerations, classified under multiple acute toxicity categories and requiring careful handling protocols. Its classification includes Acute Toxicity Category 3 and 4 designations, along with skin sensitization potential, necessitating appropriate personal protective equipment and controlled work environments. The substance also presents environmental concerns with Aquatic Acute 1 and Aquatic Chronic 1 classifications, requiring specialized waste management procedures. Transportation falls under ADR Class 6.1, reflecting its toxic nature. Primary industrial applications include agricultural chemical synthesis, where its organophosphorus structure provides essential building blocks for pesticide development, and specialized pharmaceutical intermediates requiring benzoxazolone derivatives. The compound also finds use in research applications studying organophosphorus chemistry, particularly in contexts involving compounds structurally related to N-methylaniline derivatives and other nitrogen-containing heterocycles. As a specialized distributor of technical chemicals, OYSI maintains availability of this compound for qualified industrial customers throughout Europe, ensuring proper regulatory compliance and safe handling protocols.
Safety & Classification
Acute Tox. 4 *; Acute Tox. 4 *; Acute Tox. 3 *; 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
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
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 | III |
| Tunnel Code | E |
| Proper Shipping Name | Phosalon (ISO) |
| Marine Pollutant | No |
Frequently Asked Questions
What is 6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one?
6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one is an organophosphorus compound with the molecular formula C12H15ClNO4PS2 and CAS number 2310-17-0. This chemical substance has a molecular weight of 367.8 g/mol and contains a benzoxazolone core structure with chloro and phosphinothioyl substituents. It is classified as a hazardous chemical requiring careful handling due to its toxicity profile and environmental impact potential.
What are the physicochemical properties of 6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one?
6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one is a solid organophosphorus compound at room temperature with a molecular weight of 367.8 g/mol. The compound contains both hydrophobic aromatic components and polar phosphorus-sulfur functionalities, affecting its solubility characteristics. Its specific physical properties such as melting point, density, and exact solubility parameters would need to be determined through analytical testing or consultation of detailed technical specifications.
What is 6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one used for?
6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one is primarily used as a chemical intermediate in pharmaceutical and agrochemical synthesis processes. Its organophosphorus structure makes it valuable for developing compounds with biological activity. The substance may also serve as a research chemical for academic and industrial laboratories working on pesticide development, pharmaceutical research, or studies involving organophosphorus chemistry and benzoxazolone derivatives.
How to handle 6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one safely?
6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one requires strict safety measures due to its acute toxicity and skin sensitization potential. Personnel must wear appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing. Work should be conducted in well-ventilated areas or under fume hoods. Avoid skin contact, inhalation, and ingestion. Emergency procedures and first aid measures should be readily available, and all personnel should be trained on proper handling protocols.
How to store 6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one correctly?
6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one should be stored in a cool, dry, well-ventilated area away from heat sources and incompatible materials. The container must be tightly sealed and properly labeled with hazard warnings. Storage areas should be equipped with appropriate containment measures and restricted to authorized personnel only. Given its toxicity classification, the substance should be segregated from food, feed, and consumer products, with inventory tracking maintained for regulatory compliance.
What to do in case of contact with 6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one?
Immediate action is required in case of contact with 6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one due to its acute toxicity. For skin contact, remove contaminated clothing and wash affected area thoroughly with soap and water. In case of eye contact, flush immediately with plenty of water for at least 15 minutes. If ingested or inhaled, seek immediate medical attention. Remove the person from exposure and ensure fresh air. Contact poison control center and provide the safety data sheet to medical personnel.
How to dispose of 6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one appropriately?
6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one must be disposed of through authorized hazardous waste disposal facilities due to its toxicity and environmental hazard classification. The substance cannot be disposed of in regular waste streams or sewage systems. Waste disposal must comply with local, national, and European regulations including the Waste Framework Directive. Contact licensed waste management companies specialized in handling toxic chemical waste, and maintain proper documentation for regulatory compliance and traceability.
How to transport 6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one?
6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one is classified as ADR Class 6.1 (Toxic substances), Packing Group III for transport purposes. The substance requires proper packaging, labeling with appropriate hazard placards, and transport documentation including shipping papers and emergency response information. Only qualified carriers with proper permits should handle the transportation. Packages must meet UN specification requirements and display the correct shipping name, identification number, and hazard labels according to dangerous goods regulations.
Is 6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one subject to specific regulations?
6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one is subject to REACH regulation for registration, evaluation, and authorization of chemicals in the European Union. The substance is classified under CLP regulation with specific hazard classifications including acute toxicity and environmental hazards. While not currently listed as a Substance of Very High Concern (SVHC), it requires proper safety data sheets, hazard communication, and may be subject to use restrictions depending on application and quantities handled.
Where to buy 6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one in Europe?
6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one is available through OYSI, a specialized European distributor of technical chemicals and intermediates. OYSI provides this substance to qualified industrial customers, research institutions, and chemical manufacturers with proper documentation and regulatory compliance. As a controlled chemical due to its hazard classification, purchase requires verification of intended use, proper storage facilities, and compliance with relevant safety and environmental regulations. Contact OYSI's technical team for availability and specification details.
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6-chloro-3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-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.