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61312-59-2
Catalog No.:AA00E8ME

61312-59-2 | Isobutyl 2-(2-Nitro-Benzylidene)Acetoacetate

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  • Technical Information
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Technical Information
Catalog Number:
AA00E8ME
Chemical Name:
Isobutyl 2-(2-Nitro-Benzylidene)Acetoacetate
CAS Number:
61312-59-2
Molecular Formula:
C15H17NO5
Molecular Weight:
291.2992
SMILES:
CC(C)COC(=O)C(=CC1=CC=CC=C1[N+](=O)[O-])C(=O)C
Properties
Properties
 
MP:
70-72°C  
Storage:
Light sensitive;-20 ℃;Inert atmosphere;  

Computed Properties
 
Complexity:
436  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
6  
Undefined Bond Stereocenter Count:
1  
XLogP3:
3  

Literature
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Additional Info:
SDS
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