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AB01258

178748-05-5 | Methyl 2-fluoro-3-(trifluoromethyl)benzoate

Packsize Purity Availability Price Discounted Price    Quantity
250mg 95% in stock $59.00 $41.00 -   +
1g 95% in stock $95.00 $67.00 -   +
5g 95% in stock $219.00 $153.00 -   +

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Description
Catalog Number: AB01258
Chemical Name: Methyl 2-fluoro-3-(trifluoromethyl)benzoate
CAS Number: 178748-05-5
Molecular Formula: C9H6F4O2
Molecular Weight: 222.1364
MDL Number: MFCD06203703
SMILES: COC(=O)c1cccc(c1F)C(F)(F)F

 

Computed Properties
Complexity: 239  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 2  
XLogP3: 2.4  

 

 

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