Home Nitro Compounds 6325-93-5
6325-93-5,MFCD00007937
Catalog No.:AA003636

6325-93-5 | 4-Nitrobenzenesulfonamide

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Purity
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Price(USD)
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1g
97%
in stock  
$11.00   $8.00
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5g
97%
in stock  
$13.00   $9.00
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10g
97%
in stock  
$16.00   $11.00
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25g
97%
in stock  
$38.00   $27.00
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100g
96%
in stock  
$128.00   $90.00
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500g
97%
in stock  
$239.00   $167.00
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  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003636
Chemical Name:
4-Nitrobenzenesulfonamide
CAS Number:
6325-93-5
Molecular Formula:
C6H6N2O4S
Molecular Weight:
202.1878
MDL Number:
MFCD00007937
SMILES:
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)N
NSC Number:
31148
Properties
Properties
 
BP:
417.8°C at 760 mmHg  
Form:
Solid  
MP:
177-182 °C  
Refractive Index:
1.6490 (estimate)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
281  
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: Determination of structural and vibrational spectroscopic properties of 2-, 3-, 4-nitrobenzenesulfonamide using FT-IR and FT-Raman experimental techniques and DFT quantum chemical calculations.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120101

Title: N-Benzoyl-4-nitro-benzene-sulfonamide monohydrate.

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

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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Tags:6325-93-5 Molecular Formula|6325-93-5 MDL|6325-93-5 SMILES|6325-93-5 4-Nitrobenzenesulfonamide |Organic_Building_Blocks