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1311316-89-8,MFCD18483192
Catalog No.:AA01DU98

1311316-89-8 | methyl 2-{4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-1-yl}acetate

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  • Technical Information
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Technical Information
Catalog Number:
AA01DU98
Chemical Name:
methyl 2-{4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-1-yl}acetate
CAS Number:
1311316-89-8
Molecular Formula:
C8H8N4O3
Molecular Weight:
208.1741
MDL Number:
MFCD18483192
SMILES:
COC(=O)Cn1ncc2c1nc[nH]c2=O
Properties
Computed Properties
 
Complexity:
317  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
-0.2  

Literature
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Additional Info:
SDS
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Tags:1311316-89-8 Molecular Formula|1311316-89-8 MDL|1311316-89-8 SMILES|1311316-89-8 methyl 2-{4-oxo-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-1-yl}acetate