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AI54648

6645-81-4 | 3-(4-Iodo-3,5-dimethyl-1h-pyrazol-1-yl)propanoic acid

Packsize Purity Availability Price Discounted Price    Quantity
1g 95% in stock $323.00 $226.00 -   +
5g 95% in stock $931.00 $652.00 -   +

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Description
Catalog Number: AI54648
Chemical Name: 3-(4-Iodo-3,5-dimethyl-1h-pyrazol-1-yl)propanoic acid
CAS Number: 6645-81-4
Molecular Formula: C8H11IN2O2
Molecular Weight: 294.0896
MDL Number: MFCD09878862
SMILES: OC(=O)CCn1nc(c(c1C)I)C

 

Computed Properties
Complexity: 201  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 3  
XLogP3: 1.1  

 

 

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