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AI56319

778531-36-5 | Ethyl (2Z)-2-hydroxy-4-oxo-4-(pyridin-3-yl)but-2-enoate

Packsize Purity Availability Price Discounted Price    Quantity
1g 97% in stock $251.00 $176.00 -   +
5g 97% in stock $915.00 $641.00 -   +

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Description
Catalog Number: AI56319
Chemical Name: Ethyl (2Z)-2-hydroxy-4-oxo-4-(pyridin-3-yl)but-2-enoate
CAS Number: 778531-36-5
Molecular Formula: C11H11NO4
Molecular Weight: 221.2093
MDL Number: MFCD26684187
SMILES: CCOC(=O)/C(=C/C(=O)c1cccnc1)/O

 

Computed Properties
Complexity: 298  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 5  
Undefined Bond Stereocenter Count: 1  
XLogP3: 1.4  

 

 

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