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Home Other Building Blocks 106271-61-8
106271-61-8,MFCD00172954
Catalog No.:AA00ION5

106271-61-8 | 2-(5-cyano-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)ethyl 4-methylbenzene-1-sulfonate

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Technical Information
Catalog Number:
AA00ION5
Chemical Name:
2-(5-cyano-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)ethyl 4-methylbenzene-1-sulfonate
CAS Number:
106271-61-8
Molecular Formula:
C14H13N3O5S
Molecular Weight:
335.3351
MDL Number:
MFCD00172954
SMILES:
N#Cc1cn(CCOS(=O)(=O)c2ccc(cc2)C)c(=O)[nH]c1=O
Properties
Computed Properties
 
Complexity:
662  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
0.5  

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SDS
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Tags:106271-61-8 Molecular Formula|106271-61-8 MDL|106271-61-8 SMILES|106271-61-8 2-(5-cyano-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)ethyl 4-methylbenzene-1-sulfonate