Ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane

C14H14NO4PS

ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane

CAS19624-22-7

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Identification

CAS Number
19624-22-7
EC Number
243-194-4
UN Number
1380
PubChem CID
15764013

Physical-chemical properties

Molecular Formula
C14H14NO4PS
Molar Mass
323.31 g/mol
IUPAC Name
ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane

Chemical Identifiers

InChI
InChI=1S/C14H14NO4PS/c1-2-18-20(21,14-6-4-3-5-7-14)19-13-10-8-12(9-11-13)15(16)17/h3-11H,2H2,1H3/t20-/m0/s1
InChI Key
AIGRXSNSLVJMEA-FQEVSTJZSA-N

Overview

Ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane (CAS 2104-64-5) is an organophosphorus compound with high acute toxicity and environmental hazard properties. This specialized organophosphorus derivative features a complex molecular structure containing phosphorus, sulfur, and nitro-aromatic functionalities within its C14H14NO4PS framework. With a molecular weight of 323.31 g/mol and EC number 218-276-8, this compound represents a significant example of lambda5-phosphane chemistry where the phosphorus center exhibits expanded valency coordination. The substance presents considerable safety considerations due to its classification under Acute Toxicity Categories 1 and 2, requiring strict handling protocols and appropriate personal protective equipment. Its environmental impact classification as Aquatic Acute 1 and Aquatic Chronic 1 indicates substantial risks to aquatic ecosystems, necessitating careful containment and disposal procedures. The compound falls under ADR Class 6.1 for transportation, reflecting its toxic nature, and displays both skull and crossbones (GHS06) and environmental hazard (GHS09) pictograms with a "Danger" signal word. In industrial applications, ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane typically serves as a specialized intermediate in organic synthesis, particularly in the development of phosphorus-containing bioactive compounds. The compound finds use in advanced materials research and as a reagent in specialized chemical transformations. Its structural relationship to compounds like diethoxy-(4-methylsulfinylphenoxy)-sulfanylidene-lambda5-phosphane demonstrates the versatility of this chemical class in synthetic applications. OYSI maintains availability of this specialized organophosphorus compound for qualified industrial customers requiring high-purity technical materials for research and development applications.

Safety & Classification

No Hazard Classification

This substance is not classified as hazardous according to CLP Regulation (EC) No 1272/2008.

Transport (ADR)

UN Number1380
ADR Class4.2
Packing GroupI
Tunnel CodeB/E
Proper Shipping NamePentaboran
Marine PollutantNo

Frequently Asked Questions

What is ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane?

Ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane is an organophosphorus compound with the molecular formula C14H14NO4PS and CAS number 2104-64-5. This chemical has a molecular weight of 323.31 g/mol and contains phosphorus, sulfur, and nitro functional groups. It is classified as highly toxic with acute toxicity categories 1 and 2, making it a dangerous substance requiring specialized handling procedures and safety measures.

What are the physicochemical properties of ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane?

Ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane is a complex organophosphorus compound with a molecular weight of 323.31 g/mol. The presence of nitrophenoxy groups typically imparts a yellowish coloration to such compounds. Its structure contains both hydrophilic and lipophilic portions, affecting its solubility properties. The exact physical state, odor, and detailed solubility data would require specific testing due to the compound's specialized nature.

What is ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane used for?

Ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane is primarily used in specialized chemical synthesis and research applications. As an organophosphorus compound, it may serve as an intermediate in the production of pharmaceuticals, agrochemicals, or other fine chemicals. Its specific applications are typically limited to professional and industrial settings due to its high toxicity classification, requiring specialized facilities and trained personnel for safe handling.

How to handle ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane safely?

Ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane must be handled with extreme caution due to its Acute Tox. 1 and 2 classifications. Essential personal protective equipment includes chemical-resistant gloves, safety goggles, and respiratory protection. Work should be conducted in well-ventilated areas or fume hoods. Avoid skin and eye contact, inhalation, and ingestion. Emergency procedures and antidotes should be readily available, and only trained personnel should handle this substance.

How to store ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane correctly?

Ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane should be stored in a cool, dry, well-ventilated area away from heat sources and incompatible materials. Use original containers with secure closures and proper labeling including GHS06 and GHS09 pictograms. Storage areas must be restricted to authorized personnel only due to the substance's high toxicity. Implement appropriate containment measures to prevent environmental release and ensure compliance with local hazardous material storage regulations.

What to do in case of contact with ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane?

Immediate action is critical due to the substance's high toxicity. For skin contact, remove contaminated clothing and wash thoroughly with soap and water for at least 15 minutes. For eye contact, flush with clean water for 15 minutes. If inhaled, move to fresh air immediately. If ingested, do not induce vomiting. Seek immediate medical attention in all cases of exposure, informing medical personnel of the specific substance and its toxicity classification.

How to dispose of ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane appropriately?

Ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane must be disposed of as hazardous waste according to local and international regulations. Due to its high toxicity and aquatic toxicity classifications, it requires specialized treatment at authorized hazardous waste facilities. Never dispose of this substance through regular waste streams or sewage systems. Contact licensed waste management companies experienced in handling toxic organophosphorus compounds for proper disposal procedures and documentation.

How to transport ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane?

Ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane is classified as ADR Class 6.1, Packing Group I, indicating it is a highly toxic substance requiring strict transport regulations. Packaging must meet UN specifications for Group I dangerous goods. Transport documentation must include proper shipping names, hazard labels, and emergency response information. Only authorized carriers experienced in handling toxic materials should transport this substance, following all applicable international dangerous goods regulations.

Is ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane subject to specific regulations?

Ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane is subject to extensive chemical regulations including REACH registration requirements in Europe and CLP classification obligations. While not currently listed as an SVHC, its high toxicity classification requires compliance with occupational safety regulations, environmental protection laws, and dangerous goods transport requirements. Users must maintain safety data sheets, implement risk management measures, and ensure proper worker training and protection protocols.

Where to buy ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane in Europe?

Ethoxy-(4-nitrophenoxy)-phenyl-sulfanylidene-lambda5-phosphane is available through specialized chemical distributors like OYSI, a European distributor of technical chemicals. Due to its high toxicity classification, procurement is typically restricted to qualified industrial users and research institutions with appropriate safety facilities and trained personnel. Buyers must demonstrate compliance with safety regulations and provide proper documentation for the intended use of this controlled substance.

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Data Sources

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