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7101-83-9,MFCD26131638
Catalog No.:AA00FGMS

7101-83-9 | 8-Cyano-4-oxo-1,4-dihydro-quinoline-2-carboxylic acid methyl ester

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Technical Information
Catalog Number:
AA00FGMS
Chemical Name:
8-Cyano-4-oxo-1,4-dihydro-quinoline-2-carboxylic acid methyl ester
CAS Number:
7101-83-9
Molecular Formula:
C12H8N2O3
Molecular Weight:
228.2035
MDL Number:
MFCD26131638
SMILES:
COC(=O)C1=CC(=O)C2=CC=CC(=C2N1)C#N
Properties
Computed Properties
 
Complexity:
432  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.3  

Literature
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Additional Info:
SDS
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Tags:7101-83-9 Molecular Formula|7101-83-9 MDL|7101-83-9 SMILES|7101-83-9 8-Cyano-4-oxo-1,4-dihydro-quinoline-2-carboxylic acid methyl ester