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Home  > Isocyanic Acid n-Octadecyl Ester

AB74890

112-96-9 | Isocyanic Acid n-Octadecyl Ester

Packsize Purity Availability Price Discounted Price    Quantity
1g 80% in stock $25.00 $18.00 -   +
25g 80% in stock $49.00 $34.00 -   +
250g 80% in stock $148.00 $104.00 -   +

*All products are for research use only and not intended for human or animal use.

*All prices are in USD.

Description
Catalog Number: AB74890
Chemical Name: Isocyanic Acid n-Octadecyl Ester
CAS Number: 112-96-9
Molecular Formula: C19H37NO
Molecular Weight: 295.5032
MDL Number: MFCD00002041
SMILES: CCCCCCCCCCCCCCCCCCN=C=O
NSC Number: 66466

 

Computed Properties
Complexity: 234  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 21  
Hydrogen Bond Acceptor Count: 2  
Rotatable Bond Count: 17  
Undefined Atom Stereocenter Count: 1  
XLogP3: 9.8  

 

 

Upstream Synthesis Route
  • 1-Octadecyl isocyanate is a versatile compound widely utilized in various chemical synthesis processes. This organic compound consists of an alkyl chain with 18 carbon atoms attached to an isocyanate functional group. Its unique chemical structure enables a multitude of applications in the field of organic chemistry. In chemical synthesis, 1-Octadecyl isocyanate serves as a valuable building block for creating complex molecules through reactions with a variety of functional groups. It is commonly employed in the production of surfactants, polymers, and other specialty chemicals. Additionally, it can be utilized as a reactive intermediate in the synthesis of organic compounds for pharmaceuticals, agrochemicals, and materials science. Due to its reactivity and ability to undergo various transformations, 1-Octadecyl isocyanate plays a crucial role in the development of novel chemical entities with diverse applications.
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