N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide

C14H13Cl2N2O2PS

CAS4104-14-7
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
4104-14-7
EC Number
223-874-7
UN Number
2783
Index Number
015-092-00-8
PubChem CID
20056

Physical-chemical properties

Molecular Formula
C14H13Cl2N2O2PS
Molar Mass
375.20 g/mol
IUPAC Name
N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide

Chemical Identifiers

InChI
InChI=1S/C14H13Cl2N2O2PS/c1-10(17)18-21(22,19-13-6-2-11(15)3-7-13)20-14-8-4-12(16)5-9-14/h2-9H,1H3,(H2,17,18,22)
InChI Key
XIBXUAZIZXDFTG-UHFFFAOYSA-N

Overview

N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide (CAS 4104-14-7) is an organophosphorus compound with pronounced toxicological properties and environmental hazard potential. This specialized organophosphorus derivative represents a complex molecular structure combining phosphinothioyl functionality with chlorinated phenoxy groups and an ethanimidamide moiety. With its molecular formula C14H13Cl2N2O2PS and molecular weight of 375.2 g/mol, this compound exhibits significant biological activity that necessitates stringent handling protocols. The presence of two 4-chlorophenoxy substituents attached to the phosphorus center contributes to its distinct chemical behavior and toxicological profile. The compound falls under multiple acute toxicity classifications (Acute Tox. 1 and 2), indicating extremely hazardous properties requiring expert handling procedures. Its environmental classification as Aquatic Acute 1 and Aquatic Chronic 1 reflects severe toxicity to aquatic organisms with long-lasting effects. Transport regulations classify it under ADR Class 6.1, emphasizing its toxic nature. The mandatory GHS pictograms GHS06 (skull and crossbones) and GHS09 (environmental hazard) with the signal word "Danger" underscore the critical safety considerations. This compound belongs to a broader family of organophosphorus derivatives that includes related substances such as diethoxy-(4-methylsulfinylphenoxy)-sulfanylidene-lambda5-phosphane, which shares similar phosphorus-based structural elements but differs in its substituent pattern. Primary industrial applications include specialized research applications, pharmaceutical intermediate synthesis, and specific agrochemical formulations where its unique molecular properties provide distinct advantages. The compound's complex structure makes it valuable in applications requiring precise biological activity modulation. OYSI maintains availability of N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide through its European distribution network, ensuring compliance with all relevant safety and regulatory requirements.

Safety & Classification

Danger
Classification:

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

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

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

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 GroupI
Tunnel CodeC/E
Proper Shipping NamePhosacetim (ISO)
Marine PollutantNo

Frequently Asked Questions

What is N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide?

N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide is an organophosphorus compound with the CAS number 4104-14-7 and molecular formula C14H13Cl2N2O2PS. This chemical substance has a molecular weight of 375.2 g/mol and contains phosphorus, sulfur, nitrogen, and two chlorinated phenoxy groups in its structure. It is classified as highly toxic and poses significant environmental hazards, requiring careful handling and specialized safety measures during use.

What are the physicochemical properties of N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide?

N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide is an organic compound with a molecular weight of 375.2 g/mol and the molecular formula C14H13Cl2N2O2PS. The compound contains chlorinated aromatic rings, phosphorus, and sulfur atoms, which influence its chemical behavior and stability. Specific physical properties such as melting point, boiling point, and solubility characteristics should be referenced from the safety data sheet for precise handling and formulation requirements.

What is N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide used for?

N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide is primarily used in specialized industrial applications due to its organophosphorus structure. Given its high toxicity classification and environmental hazard profile, this compound is typically employed in controlled professional settings where its specific chemical properties are required. Applications may include research and development, chemical synthesis intermediates, or specialized industrial processes requiring strict safety protocols and environmental containment measures.

How to handle N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide safely?

N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide requires extreme safety precautions due to its Acute Toxicity Category 1 and 2 classifications. Essential protective equipment includes chemical-resistant gloves, eye protection, respiratory protection, and full body coverage. Work must be conducted in well-ventilated areas or under fume hoods. Avoid skin contact, inhalation, and ingestion. Emergency procedures and decontamination materials should be immediately accessible, and only trained personnel should handle this substance.

How to store N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide correctly?

N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide must be stored in a secure, well-ventilated area away from incompatible materials, heat sources, and ignition sources. The storage area should be accessible only to authorized personnel due to its high toxicity. Containers must be properly labeled with GHS06 and GHS09 pictograms and kept tightly sealed. Storage should comply with local regulations for highly toxic substances and include appropriate spill containment measures and emergency response equipment.

What to do in case of contact with N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide?

Immediate medical attention is required for any contact with N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide due to its extreme toxicity. For skin contact, remove contaminated clothing and flush with copious amounts of water. In case of eye contact, rinse immediately with water for at least 15 minutes. If inhaled, move to fresh air immediately. For ingestion, do not induce vomiting and seek emergency medical care. Contact poison control centers and provide the safety data sheet to medical personnel.

How to dispose of N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide properly?

N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide must be disposed of as hazardous waste through licensed waste management companies specializing in toxic chemical disposal. Due to its high toxicity and environmental hazard classification, it cannot be disposed of in regular waste streams. Disposal must comply with local, national, and European waste regulations including the Waste Framework Directive. Incineration at authorized high-temperature facilities or chemical treatment may be required depending on local regulations.

How to transport N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide?

N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide is classified as ADR Class 6.1 (Toxic substances) Packing Group I, indicating its high toxicity level for transport. Transportation requires specialized packaging, proper labeling with toxic substance placards, and compliance with ADR regulations for dangerous goods. Only certified carriers qualified for toxic substance transport should handle shipments. Transport documentation must include proper shipping names, hazard classes, and emergency response information according to international dangerous goods regulations.

Is N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide subject to special regulations?

N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide is subject to extensive regulatory oversight under European chemical legislation including REACH registration requirements and CLP classification and labeling regulations. While not currently listed as a Substance of Very High Concern (SVHC), its high toxicity classification requires strict compliance with occupational safety regulations, environmental protection measures, and potentially restricted use authorizations. Users must maintain safety data sheets and ensure proper risk assessments are conducted.

Where to buy N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide in Europe?

N'-bis(4-chlorophenoxy)phosphinothioylethanimidamide is available through OYSI, a specialized European distributor of technical chemicals. As a highly toxic substance requiring specialized handling, it is only supplied to qualified professional users with appropriate safety infrastructure and regulatory compliance. OYSI provides comprehensive documentation including safety data sheets, certificates of analysis, and regulatory support to ensure proper handling and compliance with European chemical regulations for this hazardous material.

Data Sources

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