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Home Carboxes 97-09-6
97-09-6,MFCD00035783
Catalog No.:AA003JPW

97-09-6 | 4-Chloro-3-nitrobenzenesulfonamide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$6.00   $4.00
- +
5g
98%
in stock  
$8.00   $6.00
- +
10g
98%
in stock  
$11.00   $8.00
- +
100g
98%
in stock  
$32.00   $22.00
- +
  • Technical Information
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  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003JPW
Chemical Name:
4-Chloro-3-nitrobenzenesulfonamide
CAS Number:
97-09-6
Molecular Formula:
C6H5ClN2O4S
Molecular Weight:
236.6329
MDL Number:
MFCD00035783
SMILES:
[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)N
NSC Number:
512314
Properties
Properties
 
BP:
427.9 °C at 760mmHg  
Form:
Solid  
Refractive Index:
1.6000 (estimate)  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
320  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
0.8  

Literature

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: Nitrobenzene compounds inhibit expression of VCAM-1.

Journal: Bioorganic & medicinal chemistry letters 20010723

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SDS
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Tags:97-09-6 Molecular Formula|97-09-6 MDL|97-09-6 SMILES|97-09-6 4-Chloro-3-nitrobenzenesulfonamide