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AI54619

6627-91-4 | 2-(Cyanomethyl)benzoic acid

Packsize Purity Availability Price Discounted Price    Quantity
1g 97% in stock $163.00 $114.00 -   +
5g 97% in stock $573.00 $402.00 -   +
10g 97% in stock $884.00 $619.00 -   +

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Description
Catalog Number: AI54619
Chemical Name: 2-(Cyanomethyl)benzoic acid
CAS Number: 6627-91-4
Molecular Formula: C9H7NO2
Molecular Weight: 161.1574
MDL Number: MFCD00020293
SMILES: N#CCc1ccccc1C(=O)O

 

Computed Properties
Complexity: 216  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 2  
XLogP3: 1.8  

 

 

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