Home Nitro Compounds 96-74-2
96-74-2,MFCD00044068
Catalog No.:AA00IJNH

96-74-2 | 2-Methanesulfonyl-4-nitroaniline

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1g
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$33.00   $23.00
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Technical Information
Catalog Number:
AA00IJNH
Chemical Name:
2-Methanesulfonyl-4-nitroaniline
CAS Number:
96-74-2
Molecular Formula:
C7H8N2O4S
Molecular Weight:
216.2144
MDL Number:
MFCD00044068
SMILES:
[O-][N+](=O)c1ccc(c(c1)S(=O)(=O)C)N
Properties
Computed Properties
 
Complexity:
316  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
0.9  

Literature

Title: Hydrogen bonding in C-substituted nitroanilines: a chain of R3 3(12)rings in 2-methanesulfonyl-4-nitroaniline.

Journal: Acta crystallographica. Section C, Crystal structure communications 20040101

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Tags:96-74-2 Molecular Formula|96-74-2 MDL|96-74-2 SMILES|96-74-2 2-Methanesulfonyl-4-nitroaniline