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28791-26-6

28791-26-6 | Benzenesulfonamide, 3-nitro-N-phenyl-

CAS No: 28791-26-6 Catalog No: AG002WHD MDL No:

Product Description

Catalog Number:
AG002WHD
Chemical Name:
Benzenesulfonamide, 3-nitro-N-phenyl-
CAS Number:
28791-26-6
Molecular Formula:
C12H10N2O4S
Molecular Weight:
278.2838
IUPAC Name:
3-nitro-N-phenylbenzenesulfonamide
InChI:
InChI=1S/C12H10N2O4S/c15-14(16)11-7-4-8-12(9-11)19(17,18)13-10-5-2-1-3-6-10/h1-9,13H
InChI Key:
OXJDTNIWMQCOQT-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)S(=O)(=O)Nc1ccccc1
EC Number:
249-225-8

Properties

Complexity:
406  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.036g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
278.282g/mol
Monoisotopic Mass:
278.036g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Literature

Title Journal
Antifungal activities of N-arylbenzenesulfonamides against phytopathogens and control efficacy on wheat leaf rust and cabbage club root diseases. Bioscience, biotechnology, and biochemistry 20021201

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