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AE16394

105416-56-6 | Azepan-4-one

Packsize Purity Availability Price Discounted Price    Quantity
1g 95% in stock $249.00 $175.00 -   +
5g 95% in stock $758.00 $531.00 -   +

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Description
Catalog Number: AE16394
Chemical Name: Azepan-4-one
CAS Number: 105416-56-6
Molecular Formula: C6H11NO
Molecular Weight: 113.1576
MDL Number: MFCD01318553
SMILES: O=C1CCNCCC1

 

Computed Properties
Complexity: 90.5  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 8  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Undefined Atom Stereocenter Count: 1  
XLogP3: -0.4  

 

 

Upstream Synthesis Route 
  • Azepan-4-one, also known as caprolactam, is a versatile chemical compound widely used in chemical synthesis. Its cyclic structure consists of seven atoms, providing a unique framework for various reactions in organic chemistry. One key application of azepan-4-one is its role as a precursor in the synthesis of nylon-6, a popular and durable polymer used in textiles, plastics, and other industrial materials. Additionally, azepan-4-one serves as a crucial building block in the production of pharmaceuticals, agrochemicals, and fine chemicals. Its structural flexibility and reactivity make it an essential component in the design and development of new compounds with diverse applications in the field of chemistry.
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