7-diethoxyphosphinothioyloxy-4-methylchromen-2-one

C14H17O5PS

CAS299-45-6
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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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 highly toxic properties and environmental hazard classification. This organophosphorus derivative represents a specialized chemical compound featuring a coumarin backbone modified with a diethoxyphosphinothioyl group. With a molecular formula of C14H17O5PS and molecular weight of 328.32 g/mol, this substance belongs to the family of phosphorothioate esters, which are known for their biological activity and toxicological significance. The compound's structure combines the lactone ring system characteristic of coumarins with the phosphorus-sulfur functionality typical of organophosphorus chemicals. The substance presents significant safety considerations, classified under multiple acute toxicity categories (Acute Tox. 1 and Acute Tox. 2) with the "Danger" signal word and GHS pictograms GHS06 (skull and crossbones) and GHS09 (environment). Its ADR classification as Class 6.1 indicates it requires specialized handling and transportation protocols as a toxic substance. The compound also carries aquatic toxicity classifications (Aquatic Acute 1 and Aquatic Chronic 1), emphasizing its potential environmental impact and the need for careful containment and disposal procedures. Industrial applications typically involve specialized research and development activities where organophosphorus chemistry expertise is required. Like other organophosphorus compounds in this chemical family, including formonitrile derivatives, it may find use in pharmaceutical intermediate synthesis or specialized agricultural chemistry applications. The compound requires expert handling due to its toxicological profile and environmental considerations. OYSI maintains availability of this specialized organophosphorus compound for qualified industrial customers with appropriate safety protocols and regulatory compliance frameworks.

Safety & Classification

Danger
Classification:

Acute Tox. 2 *; Acute Tox. 1; Acute Tox. 2 *; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H330

Fatal if inhaled.

H310

Fatal in contact with skin.

H300

Fatal 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

Inhalation

Fatal

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

Fatal

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

Fatal

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 NamePotasan, fest
Marine PollutantNo

Frequently Asked Questions

What is 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one?

7-diethoxyphosphinothioyloxy-4-methylchromen-2-one is an organophosphorus compound with CAS number 299-45-6 and molecular formula C14H17O5PS. This chemical substance has a molecular weight of 328.32 g/mol and belongs to the coumarin derivative family. It is classified as highly toxic with acute toxicity properties and presents significant environmental hazards to aquatic life, requiring careful handling and specialized safety measures in industrial applications.

What are the physicochemical properties of 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one?

7-diethoxyphosphinothioyloxy-4-methylchromen-2-one is an organic compound with molecular formula C14H17O5PS and molecular weight 328.32 g/mol. As an organophosphorus derivative containing both phosphorus and sulfur atoms, it exhibits specific chemical reactivity patterns. The compound's exact physical appearance, solubility, and stability parameters depend on storage conditions and purity grade, requiring consultation of detailed technical specifications for precise physicochemical data.

What is 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one used for?

7-diethoxyphosphinothioyloxy-4-methylchromen-2-one serves as a specialized chemical intermediate in pharmaceutical and agrochemical synthesis. Its organophosphorus structure makes it valuable for research applications and as a building block in organic chemistry. The compound may be used in the development of bioactive molecules, though specific applications require careful evaluation due to its high toxicity classification and environmental impact potential.

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. Personnel must wear appropriate PPE including chemical-resistant gloves, protective clothing, and respiratory protection. Work should be conducted in well-ventilated areas or under fume hoods. Avoid skin contact, inhalation, and ingestion. Emergency procedures and safety data sheets must be readily available to all handlers.

How to store 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one correctly?

7-diethoxyphosphinothioyloxy-4-methylchromen-2-one should be stored in tightly sealed containers in a cool, dry, well-ventilated area away from incompatible materials. Due to its high toxicity and environmental hazard classification, storage areas must be secure and restricted to authorized personnel only. Containers should be properly labeled with hazard information and stored according to local chemical storage regulations, separated from oxidizing agents and other reactive substances.

What to do in case of contact with 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one?

Immediate action is required for any contact with 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one due to its acute toxicity. For skin contact, remove contaminated clothing and rinse thoroughly with water for at least 15 minutes. If inhaled, move to fresh air immediately. For eye contact, flush with water for 15 minutes. Seek immediate medical attention in all cases of exposure and provide safety data sheet information to medical personnel.

How to dispose of 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one appropriately?

Disposal of 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one must comply with local and national hazardous waste regulations due to its high toxicity and environmental hazard classification. The substance requires treatment as hazardous waste and should be collected by licensed waste disposal companies. Incineration at high temperatures in specialized facilities is typically required. Never dispose of this material in regular waste streams or discharge into the environment.

How to transport 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one?

Transportation of 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one is regulated under ADR Class 6.1 (toxic substances), Packing Group II. Proper shipping documentation, hazard labels, and certified packaging are mandatory. Vehicles must carry appropriate emergency equipment and drivers require hazardous materials training. The substance must be secured to prevent spillage and separated from incompatible materials during transport. Emergency response information must accompany shipments.

Is 7-diethoxyphosphinothioyloxy-4-methylchromen-2-one subject to specific regulations?

7-diethoxyphosphinothioyloxy-4-methylchromen-2-one is subject to multiple regulatory frameworks including REACH registration requirements, CLP classification as Acute Tox. 1/2 and aquatic hazard categories. While not currently listed as SVHC, its high toxicity profile means it falls under strict handling and notification requirements. Companies must ensure proper risk assessments, safety data sheets, and compliance with occupational health regulations before use.

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. As a highly regulated toxic substance, procurement requires proper authorization, safety documentation, and compliance with local regulations. OYSI provides technical support and ensures proper handling procedures for this specialized chemical. Contact OYSI directly for availability, technical specifications, and regulatory compliance assistance for your specific application requirements.

Data Sources

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