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478259-76-6,MFCD02571401
Catalog No.:AA00IYXA

478259-76-6 | N-[(3-chloro-4-methoxyphenyl)methyl]-2,4-dinitroaniline

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Technical Information
Catalog Number:
AA00IYXA
Chemical Name:
N-[(3-chloro-4-methoxyphenyl)methyl]-2,4-dinitroaniline
CAS Number:
478259-76-6
Molecular Formula:
C14H12ClN3O5
Molecular Weight:
337.7152
MDL Number:
MFCD02571401
SMILES:
COc1ccc(cc1Cl)CNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
428  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
4.2  

Literature
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Additional Info:
SDS
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Tags:478259-76-6 Molecular Formula|478259-76-6 MDL|478259-76-6 SMILES|478259-76-6 N-[(3-chloro-4-methoxyphenyl)methyl]-2,4-dinitroaniline