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Home  > 1-Phenyl-5-propyl-1h-pyrazole-4-carboxylic acid

AA15707

116344-17-3 | 1-Phenyl-5-propyl-1h-pyrazole-4-carboxylic acid

Packsize Purity Availability Price Discounted Price    Quantity
250mg 97% in stock $47.00 $33.00 -   +
1g 97% in stock $117.00 $82.00 -   +

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Description
Catalog Number: AA15707
Chemical Name: 1-Phenyl-5-propyl-1h-pyrazole-4-carboxylic acid
CAS Number: 116344-17-3
Molecular Formula: C13H14N2O2
Molecular Weight: 230.2625
MDL Number: MFCD00068140
SMILES: CCCc1c(cnn1c1ccccc1)C(=O)O

 

Computed Properties
Complexity: 264  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 17  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 4  
XLogP3: 2.6  

 

 

Upstream Synthesis Route 
  • 1-Phenyl-5-propylpyrazole-4-carboxylic acid serves as a versatile building block in chemical synthesis due to its unique structure and reactive functional groups. This compound is commonly employed as a key intermediate in the synthesis of various pharmaceuticals and agrochemicals. As a substituted pyrazole derivative, it offers a platform for the introduction of additional substituents or modifications through traditional organic chemistry reactions. Its structural features make it an essential component in the production of diverse compounds with potential applications in medicinal chemistry, material science, and other areas of research and development.
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