Home Sulfos N-(4-Aminobutyl)-2-nitrobenzenesulfonamide

N-(4-Aminobutyl)-2-nitrobenzenesulfonamide

CAS No.:
211512-13-9
Catalog Number:
AG003DXL
Molecular Formula:
C10H15N3O4S
Molecular Weight:
273.3088
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Product Description
Catalog Number:
AG003DXL
Chemical Name:
N-(4-Aminobutyl)-2-nitrobenzenesulfonamide
CAS Number:
211512-13-9
Molecular Formula:
C10H15N3O4S
Molecular Weight:
273.3088
MDL Number:
MFCD04117909
IUPAC Name:
N-(4-aminobutyl)-2-nitrobenzenesulfonamide
InChI:
InChI=1S/C10H15N3O4S/c11-7-3-4-8-12-18(16,17)10-6-2-1-5-9(10)13(14)15/h1-2,5-6,12H,3-4,7-8,11H2
InChI Key:
NEIRGPMZEKSCSV-UHFFFAOYSA-N
SMILES:
NCCCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]
Properties
Complexity:
360  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.078g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
273.307g/mol
Monoisotopic Mass:
273.078g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties