Home Nitro Compounds 121-52-8
121-52-8,MFCD00007935
Catalog No.:AA00767H

121-52-8 | 3-Nitrobenzenesulfonamide

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1g
98%
in stock  
$6.00   $4.00
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5g
>98.0%(HPLC)(N)
in stock  
$19.00   $13.00
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25g
98%
in stock  
$29.00   $21.00
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500g
98%
in stock  
$577.00   $404.00
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  • Technical Information
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  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00767H
Chemical Name:
3-Nitrobenzenesulfonamide
CAS Number:
121-52-8
Molecular Formula:
C6H6N2O4S
Molecular Weight:
202.1878
MDL Number:
MFCD00007935
SMILES:
[O-][N+](=O)c1cccc(c1)S(=O)(=O)N
NSC Number:
407487
Properties
Computed Properties
 
Complexity:
289  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
0.6  

Literature

Title: N-(2-Chloro-benzo-yl)-2-nitro-benzene-sulfonamide.

Journal: Acta crystallographica. Section E, Structure reports online 20120201

Title: N-(2-Chloro-benzo-yl)-3-nitro-benzene-sulfonamide.

Journal: Acta crystallographica. Section E, Structure reports online 20120201

Title: N-(3-Chloro-benzo-yl)-3-nitro-benzene-sulfonamide.

Journal: Acta crystallographica. Section E, Structure reports online 20120101

Title: N-Benzoyl-3-nitro-benzene-sulfonamide.

Journal: Acta crystallographica. Section E, Structure reports online 20111201

Title: Correlation analyses on binding affinity of substituted benzenesulfonamides with carbonic anhydrase using ab initio MO calculations on their complex structures (II).

Journal: Bioorganic & medicinal chemistry letters 20110101

Title: Novel use of chemical shift in NMR as molecular descriptor: a first report on modeling carbonic anhydrase inhibitory activity and related parameters.

Journal: Bioorganic & medicinal chemistry letters 20050215

Title: Topological modeling of lipophilicity, diuretic activity, and carbonic inhibition activity of benzene sulfonamides: a molecular connectivity approach.

Journal: Bioorganic & medicinal chemistry letters 20041115

Title: Carbonic anhydrase inhibitors: inhibition of human cytosolic isozyme II and mitochondrial isozyme V with a series of benzene sulfonamide derivatives.

Journal: Bioorganic & medicinal chemistry letters 20041115

Title: Structures of three substituted arenesulfonamides from X-ray powder diffraction data using the differential evolution technique.

Journal: Acta crystallographica. Section B, Structural science 20021001

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