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AI44558

203189-41-7 | Ethyl 4-cyano-3-hydroxy-5-(methylthio)thiophene-2-carboxylate

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Description
Catalog Number: AI44558
Chemical Name: Ethyl 4-cyano-3-hydroxy-5-(methylthio)thiophene-2-carboxylate
CAS Number: 203189-41-7
Molecular Formula: C9H9NO3S2
Molecular Weight: 243.3027
MDL Number: MFCD04150086
SMILES: CCOC(=O)c1sc(c(c1O)C#N)SC

 

Computed Properties
Complexity: 288  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 4  
XLogP3: 2.9  

 

 

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