2-cyclohexylidene-2-phenylacetonitrile
C14H15N
Consulting for 2-cyclohexylidene-2-phenylacetonitrile
Our experts support you with application, dosage, and compliance.
Identification
- CAS Number
- 10461-98-0
- EC Number
- 423-740-1
- UN Number
- 3439
- Index Number
- 608-044-00-8
- PubChem CID
- 66327
Physical-chemical properties
- Molecular Formula
- C14H15N
- Molar Mass
- 197.27 g/mol
- IUPAC Name
- 2-cyclohexylidene-2-phenylacetonitrile
Chemical Identifiers
- InChI
- InChI=1S/C14H15N/c15-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1,3-4,7-8H,2,5-6,9-10H2
- InChI Key
- ZHOOOLQOWQVYOE-UHFFFAOYSA-N
Overview
2-cyclohexylidene-2-phenylacetonitrile (CAS 10461-98-0) is an organic nitrile compound with both aromatic and cycloaliphatic structural features, classified under acute toxicity and aquatic chronic hazard categories. This specialized chemical intermediate belongs to the nitrile family and features a distinctive molecular structure combining a phenyl ring with a cyclohexylidene group attached to an acetonitrile moiety. With a molecular formula of C14H15N and a molecular weight of 197.27 g/mol, this compound exhibits unique chemical properties that make it valuable for various industrial synthetic applications. The presence of both aromatic and aliphatic components in its structure provides versatility in chemical transformations and reactivity patterns. From a safety perspective, 2-cyclohexylidene-2-phenylacetonitrile is classified as Acute Tox. 4 and Aquatic Chronic 2 under GHS regulations, requiring careful handling protocols. The compound displays GHS07 and GHS09 pictograms with a "Warning" signal word, indicating moderate acute toxicity concerns and environmental hazards to aquatic life. Transportation falls under ADR Class 6.1, reflecting its toxic nature and necessitating appropriate packaging and shipping procedures. Industrial applications of this nitrile compound primarily focus on pharmaceutical intermediates and specialty chemical synthesis, where its unique structural features enable the formation of complex molecular architectures. It serves as a building block in organic synthesis, particularly in the development of bioactive compounds and advanced materials. Similar to other specialized intermediates like (3-methylphenyl) N-methylcarbamate, this compound plays a crucial role in multi-step synthetic pathways. OYSI maintains reliable supply chains for 2-cyclohexylidene-2-phenylacetonitrile, ensuring consistent availability for our European industrial customers requiring this specialized chemical intermediate.
Safety & Classification
Acute Tox. 4 *; Aquatic Chronic 2
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
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 | 3439 |
| ADR Class | 6.1 |
| Packing Group | III |
| Tunnel Code | E |
| Proper Shipping Name | 2-Cyclohexyliden-2-phenylacetonitril, fest |
| Marine Pollutant | No |
Frequently Asked Questions
What is 2-cyclohexylidene-2-phenylacetonitrile?
2-cyclohexylidene-2-phenylacetonitrile is an organic nitrile compound with the molecular formula C14H15N and CAS number 10461-98-0. This chemical features a cyclohexylidene group attached to a phenylacetonitrile structure, giving it a molecular weight of 197.27 g/mol. It is classified as moderately toxic and presents environmental hazards, requiring careful handling in industrial applications.
What are the physicochemical properties of 2-cyclohexylidene-2-phenylacetonitrile?
2-cyclohexylidene-2-phenylacetonitrile is a nitrile compound with molecular formula C14H15N and molecular weight 197.27 g/mol. As an organic nitrile containing aromatic and cyclic structures, it typically exists as a solid or viscous liquid at room temperature. The compound's specific physical properties such as melting point, boiling point, and solubility depend on the exact structural configuration and should be verified through technical data sheets.
What is 2-cyclohexylidene-2-phenylacetonitrile used for?
2-cyclohexylidene-2-phenylacetonitrile serves as an intermediate in organic synthesis and pharmaceutical manufacturing. The compound's nitrile functionality makes it valuable for producing various chemical derivatives through hydrolysis, reduction, or other chemical transformations. It may be used in the synthesis of active pharmaceutical ingredients, specialty chemicals, or as a building block in fine chemical production requiring specific molecular structures.
How to handle 2-cyclohexylidene-2-phenylacetonitrile safely?
2-cyclohexylidene-2-phenylacetonitrile requires careful handling due to its Acute Tox. 4 classification. Always wear appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing. Ensure adequate ventilation in work areas and avoid inhalation, skin contact, or ingestion. Handle in well-ventilated areas or under fume hoods, and wash hands thoroughly after use to prevent accidental exposure.
How to store 2-cyclohexylidene-2-phenylacetonitrile correctly?
2-cyclohexylidene-2-phenylacetonitrile should be stored in tightly sealed containers in a cool, dry, well-ventilated area away from heat sources and incompatible materials. Keep containers upright and properly labeled according to GHS requirements with Warning signal word and appropriate pictograms (GHS07, GHS09). Store away from oxidizing agents and strong bases, and ensure storage areas are equipped with appropriate spill containment measures.
What to do in case of contact with 2-cyclohexylidene-2-phenylacetonitrile?
In case of skin contact with 2-cyclohexylidene-2-phenylacetonitrile, immediately remove contaminated clothing and rinse affected area with plenty of water for at least 15 minutes. For eye contact, flush immediately with water and seek medical attention. If inhaled, move to fresh air immediately. In case of ingestion, do not induce vomiting and seek immediate medical attention. Always consult the safety data sheet for specific first aid measures.
How to dispose of 2-cyclohexylidene-2-phenylacetonitrile properly?
2-cyclohexylidene-2-phenylacetonitrile must be disposed of according to local and national hazardous waste regulations due to its toxicity and environmental impact classifications. Contact licensed hazardous waste disposal companies for proper treatment and disposal. Do not discharge into drains, waterways, or soil due to its Aquatic Chronic 2 classification. Contaminated packaging should also be treated as hazardous waste and disposed of appropriately.
How to transport 2-cyclohexylidene-2-phenylacetonitrile?
2-cyclohexylidene-2-phenylacetonitrile is classified under ADR Class 6.1 (Toxic substances) Packing Group III for transportation. Packages must comply with dangerous goods regulations including proper labeling, documentation, and packaging requirements. Transport vehicles must carry appropriate emergency equipment and documentation. Only use approved packaging materials and ensure drivers have proper dangerous goods training certification for Class 6.1 substances.
Is 2-cyclohexylidene-2-phenylacetonitrile subject to special regulations?
2-cyclohexylidene-2-phenylacetonitrile is subject to standard chemical regulations including REACH registration requirements in Europe and CLP classification obligations. The substance is not currently listed as an SVHC (Substance of Very High Concern). Users must comply with occupational safety regulations, environmental protection laws, and proper labeling requirements according to GHS standards including Warning signal word and specified pictograms.
Where to buy 2-cyclohexylidene-2-phenylacetonitrile in Europe?
2-cyclohexylidene-2-phenylacetonitrile is available through OYSI, a specialized European distributor of technical chemicals. OYSI provides high-quality chemical products with proper documentation, safety data sheets, and regulatory compliance support across European markets. Contact OYSI directly for availability, technical specifications, packaging options, and delivery throughout Europe while ensuring full regulatory compliance and professional handling standards.
Services for 2-cyclohexylidene-2-phenylacetonitrile
Order 2-cyclohexylidene-2-phenylacetonitrile
Fast delivery across Europe
SDS Service
Request Safety Data Sheet for 2-cyclohexylidene-2-phenylacetonitrile
Technical Consulting
Application advice for 2-cyclohexylidene-2-phenylacetonitrile
REACH Safety Data Sheet
REACH Compliance Service
Digital Product Passport
EU-compliant product documentation
ADR Consulting for 2-cyclohexylidene-2-phenylacetonitrile
2-cyclohexylidene-2-phenylacetonitrile 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.