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Home  > Chemistry  > Heterocyclic Building Blocks  > Benzisoxazoles  > 2,1-Benzisoxazole-3-carboxylic acid

AB52685

642-91-1 | 2,1-Benzisoxazole-3-carboxylic acid

Packsize Purity Availability Price Discounted Price    Quantity
250mg 98% in stock $82.00 $58.00 -   +
1g 98% in stock $201.00 $141.00 -   +
5g 98% in stock $674.00 $472.00 -   +
10g 98% in stock $1,179.00 $825.00 -   +
25g 98% in stock $2,345.00 $1,642.00 -   +

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*All prices are in USD.

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Description
Catalog Number: AB52685
Chemical Name: 2,1-Benzisoxazole-3-carboxylic acid
CAS Number: 642-91-1
Molecular Formula: C8H5NO3
Molecular Weight: 163.1302
MDL Number: MFCD02180526
SMILES: OC(=O)c1onc2c1cccc2
NSC Number: 86917

 

Computed Properties
Complexity: 195  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 1  
XLogP3: 1.6  

 

 

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