Home Sulfos N-[2-(methylamino)ethyl]-4-nitrobenzene-1-sulfonamide hydrochloride

N-[2-(methylamino)ethyl]-4-nitrobenzene-1-sulfonamide hydrochloride

CAS No.:
1832076-69-3
Catalog Number:
AG01C3TA
Molecular Formula:
C9H14ClN3O4S
Molecular Weight:
295.7432
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Product Description
Catalog Number:
AG01C3TA
Chemical Name:
N-[2-(methylamino)ethyl]-4-nitrobenzene-1-sulfonamide hydrochloride
CAS Number:
1832076-69-3
Molecular Formula:
C9H14ClN3O4S
Molecular Weight:
295.7432
MDL Number:
MFCD29762874
IUPAC Name:
N-[2-(methylamino)ethyl]-4-nitrobenzenesulfonamide;hydrochloride
InChI:
InChI=1S/C9H13N3O4S.ClH/c1-10-6-7-11-17(15,16)9-4-2-8(3-5-9)12(13)14;/h2-5,10-11H,6-7H2,1H3;1H
InChI Key:
NZCARVDUOQWDEW-UHFFFAOYSA-N
SMILES:
CNCCNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-].Cl
Properties
Complexity:
338  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.039g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
295.738g/mol
Monoisotopic Mass:
295.039g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties