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AC42752

7498-54-6 | 3-tert-Butylbenzoic acid

Packsize Purity Availability Price Discounted Price    Quantity
100mg 95% in stock $7.00 $5.00 -   +
250mg 95% in stock $15.00 $11.00 -   +
1g 95% in stock $23.00 $17.00 -   +
5g 95% in stock $106.00 $74.00 -   +

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Description
Catalog Number: AC42752
Chemical Name: 3-tert-Butylbenzoic acid
CAS Number: 7498-54-6
Molecular Formula: C11H14O2
Molecular Weight: 178.2277
MDL Number: MFCD01463861
SMILES: OC(=O)c1cccc(c1)C(C)(C)C
NSC Number: 407552

 

Computed Properties
Complexity: 191  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 2  
XLogP3: 3.7  

 

 

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