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AB78741

13602-12-5 | Isonicotinic acid n-oxide

Packsize Purity Availability Price Discounted Price    Quantity
5g 98% in stock $11.00 $8.00 -   +
25g 98% in stock $21.00 $15.00 -   +
100g 98% in stock $75.00 $52.00 -   +
500g 98% in stock $298.00 $209.00 -   +

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Description
Catalog Number: AB78741
Chemical Name: Isonicotinic acid n-oxide
CAS Number: 13602-12-5
Molecular Formula: C6H5NO3
Molecular Weight: 139.1088
MDL Number: MFCD00006209
SMILES: OC(=O)c1cc[n+](cc1)[O-]
NSC Number: 63044

 

Computed Properties
Complexity: 129  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 1  
XLogP3: -0.6  

 

 

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