[4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate
C16H12N2O2
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Identification
- CAS Number
- 47073-92-7
- EC Number
- 405-740-1
- UN Number
- 3082
- Index Number
- 615-025-00-8
- PubChem CID
- 93247
Physical-chemical properties
- Molecular Formula
- C16H12N2O2
- Molar Mass
- 264.28 g/mol
- IUPAC Name
- [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate
Chemical Identifiers
- InChI
- InChI=1S/C16H12N2O2/c1-12(13-2-6-15(7-3-13)19-10-17)14-4-8-16(9-5-14)20-11-18/h2-9,12H,1H3
- InChI Key
- SIZDMAYTWUINIG-UHFFFAOYSA-N
Overview
[4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate (CAS 47073-92-7) is an aromatic dicyanate ester monomer with thermosetting polymerization properties and high-temperature stability. This specialized chemical compound belongs to the family of cyanate esters, which are highly valued in advanced materials applications for their exceptional thermal and mechanical properties. The molecule features two cyanate functional groups (-OCN) connected through a diphenylethane backbone, providing excellent reactivity for crosslinking reactions that form polycyanurate networks. With a molecular weight of 264.28 g/mol and the molecular formula C16H12N2O2, this compound exhibits the characteristic properties that make cyanate esters indispensable in high-performance applications. Safety considerations are paramount when handling this material, as it presents multiple hazard classifications including acute toxicity, eye damage potential, and specific target organ toxicity with repeated exposure. The compound also poses environmental concerns with acute and chronic aquatic toxicity. Proper personal protective equipment and adequate ventilation are essential during processing and storage operations. Industrial applications primarily focus on aerospace and electronics sectors where exceptional thermal stability and low dielectric properties are critical. The compound serves as a key component in high-temperature composite matrices for aircraft structures and radar-transparent materials. Additionally, it finds use in electronic packaging applications where thermal cycling resistance and dimensional stability are required. While structurally different from compounds like benzene-1,4-diol, this cyanate ester shares applications in advanced polymer systems where superior thermal performance is demanded. OYSI maintains reliable supply chains for this specialized chemical, ensuring consistent availability for European industrial customers requiring high-purity cyanate ester monomers.
Safety & Classification
Acute Tox. 4 *; Acute Tox. 4 *; STOT RE 2 *; Eye Dam. 1; Aquatic Acute 1; Aquatic Chronic 1
GHS Pictograms
Exclamation Mark
GHS07
Harmful. May cause irritation, allergic reactions, or drowsiness.
Health Hazard
GHS08
Serious health hazard. May cause cancer, organ damage, or genetic defects.
Corrosion
GHS05
Corrosive. Causes severe skin burns and eye damage.
Environment
GHS09
Environmental hazard. Toxic to aquatic life with long lasting effects.
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:
Eye Contact
Measures if substance gets into the eyes
First Aid Actions
- +P305IF IN EYES:
- +P351Rinse cautiously with water for several minutes.
- +P338Remove contact lenses, if present and easy to do. Continue rinsing.
- +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 | 3082 |
| ADR Class | 9 |
| Packing Group | III |
| Tunnel Code | - |
| Proper Shipping Name | 4,4'-Ethylidendiphenyldicyanat |
| Marine Pollutant | No |
Frequently Asked Questions
What is [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate?
[4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate is an organic chemical compound with the molecular formula C16H12N2O2 and CAS number 47073-92-7. This substance features two cyanate functional groups (-OCN) attached to phenyl rings connected by an ethyl bridge. With a molecular weight of 264.28 g/mol, it belongs to the family of aromatic cyanate esters, which are important intermediate chemicals in various industrial applications.
What are the physicochemical properties of [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate?
[4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate is a solid organic compound at room temperature with a molecular weight of 264.28 g/mol. As an aromatic cyanate ester, it typically appears as a crystalline powder and exhibits limited water solubility due to its hydrophobic aromatic structure. The presence of two reactive cyanate groups makes it chemically active, particularly in polymerization reactions and thermal curing processes.
What is [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate used for?
[4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate is primarily used as a monomer and crosslinking agent in the production of high-performance polymeric materials. It serves as a key component in manufacturing advanced composite resins, particularly for aerospace and electronics applications where thermal stability and mechanical properties are critical. The compound is also utilized in the synthesis of specialized coatings and adhesives requiring superior temperature resistance.
How to handle [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate safely?
[4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate requires careful handling due to its classification as Acute Tox. 4, Eye Dam. 1, and STOT RE 2. Essential safety measures include wearing chemical-resistant gloves, safety goggles, and protective clothing. Work in well-ventilated areas or use local exhaust ventilation to prevent inhalation. Avoid contact with skin, eyes, and mucous membranes. Handle containers carefully to prevent spillage and maintain good hygiene practices.
How to store [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate correctly?
[4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate should be stored in tightly sealed containers in a cool, dry, and well-ventilated area away from heat sources and direct sunlight. Keep away from incompatible materials such as strong acids, bases, and oxidizing agents. Maintain storage temperatures below 25°C to prevent decomposition. Ensure proper labeling and segregation from other chemicals, particularly those that could react with cyanate groups.
What to do in case of contact with [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate?
Immediate action is required upon contact with [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate due to its eye damage and acute toxicity classification. For skin contact, immediately wash with plenty of soap and water. In case of eye contact, rinse immediately with water for at least 15 minutes and seek medical attention. If inhaled, move to fresh air and seek medical advice. For ingestion, do not induce vomiting and seek immediate medical attention.
How to dispose of [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate appropriately?
[4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate must be disposed of through licensed hazardous waste management facilities due to its toxicity and environmental classification (Aquatic Acute 1, Aquatic Chronic 1). The substance cannot be disposed of in regular waste streams or sewerage systems. Contact certified waste disposal companies for proper treatment methods, which may include high-temperature incineration or specialized chemical treatment to neutralize the cyanate groups safely.
How to transport [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate?
[4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate is classified as ADR Class 9 (Miscellaneous dangerous substances), Packing Group III for transport purposes. This classification requires appropriate packaging, labeling with GHS pictograms (GHS05, GHS07, GHS08, GHS09), and transport documentation. Vehicles must carry appropriate emergency equipment, and drivers need ADR certification. The substance must be secured to prevent spillage and separated from incompatible materials during transport.
Is [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate subject to specific regulations?
[4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate is subject to European REACH and CLP regulations due to its hazardous classification including acute toxicity, eye damage, and aquatic toxicity. While not currently listed as an SVHC substance, it requires safety data sheets, proper classification and labeling, and may need registration depending on quantities. Users must comply with occupational exposure limits, environmental discharge restrictions, and waste management regulations.
Where to buy [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate in Europe?
[4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate is available through OYSI, a specialized European distributor of technical chemicals. OYSI provides this compound to industrial customers requiring high-quality chemical intermediates for polymer synthesis and specialty applications. As a professional chemical distributor, OYSI ensures proper handling, documentation, and regulatory compliance for hazardous substances, supporting customers with technical expertise and reliable supply chain management across European markets.
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ADR Consulting for [4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate
[4-[1-(4-cyanatophenyl)ethyl]phenyl] cyanate 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.