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AB45318

53293-00-8 | 5-Hexynoic acid

Packsize Purity Availability Price Discounted Price    Quantity
250mg 97% in stock $10.00 $7.00 -   +
1g 97% in stock $11.00 $8.00 -   +
5g 97% in stock $33.00 $23.00 -   +
10g 97% in stock $63.00 $44.00 -   +
25g 97% in stock $140.00 $98.00 -   +
100g 97% in stock $466.00 $327.00 -   +

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Description
Catalog Number: AB45318
Chemical Name: 5-Hexynoic acid
CAS Number: 53293-00-8
Molecular Formula: C6H8O2
Molecular Weight: 112.1265
MDL Number: MFCD00066346
SMILES: C#CCCCC(=O)O

 

Computed Properties
Complexity: 118  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 8  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 3  
XLogP3: 0.7  

 

 

Upstream Synthesis Route 
  • 5-Hexynoic acid, also known as 5-hexynoic acid, is a versatile compound that finds widespread applications in chemical synthesis. It serves as a key building block in the preparation of various organic compounds due to its unique structure and reactivity.One of the primary uses of 5-Hexynoic acid in chemical synthesis is in the production of alkynes. By utilizing the terminal alkyne group in its structure, this acid can participate in alkyne coupling reactions to form carbon-carbon triple bonds. This feature makes it valuable in the creation of various acetylenic compounds used in pharmaceuticals, agrochemicals, and materials science.Additionally, 5-Hexynoic acid can be employed in the synthesis of heterocyclic compounds. Its alkyne functionality enables it to participate in diverse reactions such as Sonogashira coupling, click chemistry, and ring-closing metathesis. This versatility allows for the formation of complex ring structures with applications in drug discovery and advanced materials development.Furthermore, 5-Hexynoic acid's role extends to the preparation of functionalized organic molecules. Its terminal alkyne group can undergo various functionalization reactions, such as hydroboration, oxidation, and reduction, leading to the introduction of different functional groups. This property is crucial in the synthesis of fine chemicals and intermediates for the pharmaceutical and agrochemical industries.Overall, 5-Hexynoic acid serves as a valuable tool in chemical synthesis, offering diverse applications in the construction of complex organic compounds. Its unique structural features and reactivity make it an essential building block for the preparation of a wide range of functional molecules with significant implications in various scientific fields and industrial sectors.
Literature
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