1-octylazepan-2-one
C14H27NO
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Identification
- CAS Number
- 59227-88-2
- EC Number
- 420-040-6
- UN Number
- 3265
- Index Number
- 606-078-00-8
- PubChem CID
- 2754067
Physical-chemical properties
- Molecular Formula
- C14H27NO
- Molar Mass
- 225.37 g/mol
- IUPAC Name
- 1-octylazepan-2-one
Chemical Identifiers
- InChI
- InChI=1S/C14H27NO/c1-2-3-4-5-6-9-12-15-13-10-7-8-11-14(15)16/h2-13H2,1H3
- InChI Key
- VKAMZEDHHWTTNZ-UHFFFAOYSA-N
Overview
1-octylazepan-2-one (CAS 59227-88-2) is a nitrogen-containing heterocyclic compound featuring a seven-membered lactam ring with an octyl substituent. This specialized chemical compound, also identified by EC number 420-040-6, belongs to the azepanone family and exhibits a molecular formula of C14H27NO with a molecular weight of 225.37 g/mol. The structure combines a seven-membered azepan ring containing a ketone functionality at the 2-position with an octyl chain attached to the nitrogen atom, creating unique chemical properties that make it valuable for various industrial applications. From a safety perspective, 1-octylazepan-2-one requires careful handling due to its classification as a skin corrosive substance (Skin Corr. 1B) and skin sensitizer (Skin Sens. 1), carrying the "Danger" signal word with corresponding GHS pictograms GHS05, GHS07, and GHS09. The compound also presents environmental concerns as an aquatic chronic hazard (Category 2) and is classified under ADR transport class 8, indicating its corrosive nature during shipping and storage. Industrial applications of this azepanone derivative typically include its use as an intermediate in pharmaceutical synthesis and as a specialty solvent in chemical processing operations. The compound's unique structural features make it particularly suitable for applications requiring specific solubility characteristics and chemical reactivity patterns. While structurally distinct from related compounds such as N-cyclohexylcyclohexanamine, 1-octylazepan-2-one offers complementary properties in formulations where lactam functionality is preferred over simple amine structures. OYSI maintains availability of 1-octylazepan-2-one for qualified industrial customers requiring this specialized chemical intermediate, ensuring proper regulatory compliance and technical support throughout Europe.
Safety & Classification
Skin Corr. 1B; Skin Sens. 1; 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
Skin Contact
Measures if substance contacts the skin
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:
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 | 3265 |
| ADR Class | 8 |
| Packing Group | II |
| Tunnel Code | E |
| Proper Shipping Name | 1-Octylazepin-2-on |
| Marine Pollutant | No |
Frequently Asked Questions
What is 1-octylazepan-2-one?
1-octylazepan-2-one is an organic chemical compound with the molecular formula C14H27NO and a molecular weight of 225.37 g/mol. This substance belongs to the azepanone family, featuring a seven-membered lactam ring with an octyl side chain. It is classified as a corrosive and sensitizing chemical with significant hazard properties, requiring careful handling in industrial applications due to its skin corrosive and aquatic toxicity characteristics.
What are the physicochemical properties of 1-octylazepan-2-one?
1-octylazepan-2-one is a chemical compound with molecular formula C14H27NO and molecular mass 225.37 g/mol. As an azepanone derivative with a long alkyl chain, it likely exists as a liquid or waxy solid at room temperature. The compound contains both hydrophobic (octyl chain) and hydrophilic (lactam) portions, affecting its solubility profile. Specific physical properties such as melting point, boiling point, and exact appearance may vary depending on purity and storage conditions.
What is 1-octylazepan-2-one used for?
1-octylazepan-2-one serves as a specialized chemical intermediate in various industrial applications. Its azepanone structure makes it valuable in pharmaceutical synthesis, polymer chemistry, and as a building block for more complex molecules. The compound may also function as a solvent or processing aid in specific formulations. Due to its corrosive properties and environmental concerns, its use is typically restricted to professional industrial settings with appropriate safety measures and waste management protocols.
How to handle 1-octylazepan-2-one safely?
1-octylazepan-2-one requires strict safety protocols due to its Skin Corr. 1B and Skin Sens. 1 classifications. Essential personal protective equipment includes chemical-resistant gloves, safety goggles, and protective clothing to prevent skin contact. Work in well-ventilated areas or under fume hoods to minimize inhalation exposure. Avoid direct contact with skin and eyes, as the substance can cause severe chemical burns and allergic reactions. Emergency eyewash and safety shower facilities must be readily accessible in work areas.
How to store 1-octylazepan-2-one correctly?
1-octylazepan-2-one must be stored in tightly sealed, chemically compatible containers in a cool, dry, well-ventilated area. Keep containers away from heat sources, direct sunlight, and incompatible materials. Store separately from strong oxidizers, acids, and bases to prevent dangerous reactions. Ensure storage areas have appropriate spill containment measures and are accessible only to trained personnel. Regular container inspection is essential to detect any signs of deterioration or leakage that could lead to exposure or environmental contamination.
What to do in case of contact with 1-octylazepan-2-one?
Immediate medical attention is required for any contact with 1-octylazepan-2-one due to its corrosive nature. For skin contact, immediately remove contaminated clothing and flush affected areas with copious amounts of water for at least 15 minutes. In case of eye contact, rinse thoroughly with water for at least 15 minutes while holding eyelids open. If inhaled, move to fresh air immediately. Do not induce vomiting if ingested. Seek immediate medical attention for all exposure routes and provide safety data sheet to medical personnel.
How to dispose of 1-octylazepan-2-one properly?
1-octylazepan-2-one must be disposed of as hazardous chemical waste through licensed waste management companies. The substance cannot be discharged into sewers, soil, or waterways due to its Aquatic Chronic 2 classification and corrosive properties. Contaminated materials, including packaging and absorbents, require specialized hazardous waste treatment. Follow local and national environmental regulations for chemical waste disposal. Maintain proper documentation and waste tracking records as required by applicable legislation for corrosive and environmentally hazardous substances.
How to transport 1-octylazepan-2-one?
1-octylazepan-2-one is classified under ADR Class 8 (corrosive substances), Packing Group II, indicating moderate danger level for transport. Packaging must comply with UN specification requirements for corrosive liquids, using appropriate containers that resist chemical attack. Vehicles must carry proper hazard placards and emergency response information. Drivers require ADR certification for Class 8 substances. Transportation documents must include proper shipping names, hazard classes, and emergency contact information. Segregation from incompatible materials during transport is mandatory.
Is 1-octylazepan-2-one subject to specific regulations?
1-octylazepan-2-one is subject to European REACH regulation for chemical registration and CLP regulation for classification and labeling. While not currently listed as an SVHC (Substance of Very High Concern), its Skin Corr. 1B and Skin Sens. 1 classifications impose strict handling and labeling requirements. Users must comply with occupational exposure limits, provide safety data sheets, and implement appropriate risk management measures. Additional national regulations may apply depending on the specific use and quantities handled in different European countries.
Where to buy 1-octylazepan-2-one in Europe?
1-octylazepan-2-one is available through OYSI, a specialized European distributor of technical chemicals and laboratory reagents. As a professional chemical supplier, OYSI provides this substance to qualified industrial users, research institutions, and chemical manufacturers across Europe. All shipments comply with ADR transport regulations and include comprehensive safety documentation. Due to the hazardous nature of this substance, purchases are restricted to professional users with appropriate handling capabilities and safety infrastructure.
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Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.