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128914-79-4,MFCD00832023
Catalog No.:AA00HRSK

128914-79-4 | 4-Chloro-2-(1,2-dihydroquinolin-2-yliden)-3-oxobutanenitrile

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Technical Information
Catalog Number:
AA00HRSK
Chemical Name:
4-Chloro-2-(1,2-dihydroquinolin-2-yliden)-3-oxobutanenitrile
CAS Number:
128914-79-4
Molecular Formula:
C13H9ClN2O
Molecular Weight:
244.6764
MDL Number:
MFCD00832023
SMILES:
C1=CC=C2C(=C1)C=CC(=N2)C(=C(CCl)O)C#N
Properties
Computed Properties
 
Complexity:
358  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.2  

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SDS
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Tags:128914-79-4 Molecular Formula|128914-79-4 MDL|128914-79-4 SMILES|128914-79-4 4-Chloro-2-(1,2-dihydroquinolin-2-yliden)-3-oxobutanenitrile