Home Sulfos 2-(methylamino)-5-nitrobenzene-1-sulfonamide

2-(methylamino)-5-nitrobenzene-1-sulfonamide

CAS No.:
62533-50-0
Catalog Number:
AG01C1EV
Molecular Formula:
C7H9N3O4S
Molecular Weight:
231.2291
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Product Description
Catalog Number:
AG01C1EV
Chemical Name:
2-(methylamino)-5-nitrobenzene-1-sulfonamide
CAS Number:
62533-50-0
Molecular Formula:
C7H9N3O4S
Molecular Weight:
231.2291
MDL Number:
MFCD16661532
IUPAC Name:
2-(methylamino)-5-nitrobenzenesulfonamide
InChI:
InChI=1S/C7H9N3O4S/c1-9-6-3-2-5(10(11)12)4-7(6)15(8,13)14/h2-4,9H,1H3,(H2,8,13,14)
InChI Key:
XENLYSHPPCLMMD-UHFFFAOYSA-N
SMILES:
CNc1ccc(cc1S(=O)(=O)N)[N+](=O)[O-]
Properties
Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.031g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
231.226g/mol
Monoisotopic Mass:
231.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties