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AI63742

948594-79-4 | tert-Butyl methyl 2-(5-bromopyrimidin-2-yl)malonate

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Description
Catalog Number: AI63742
Chemical Name: tert-Butyl methyl 2-(5-bromopyrimidin-2-yl)malonate
CAS Number: 948594-79-4
Molecular Formula: C12H15BrN2O4
Molecular Weight: 331.1625
MDL Number: MFCD25509425
SMILES: COC(=O)C(C(=O)OC(C)(C)C)c1ncc(cn1)Br

 

Computed Properties
Complexity: 335  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 19  
Hydrogen Bond Acceptor Count: 6  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 1  
XLogP3: 1.8  

 

 

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