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Home > Nitro Compounds > 832730-54-8

832730-54-8

832730-54-8 | Benzenesulfonamide, N,N'-1,5-pentanediylbis[2-nitro-

CAS No: 832730-54-8 Catalog No: AG0056HQ MDL No:

Product Description

Catalog Number:
AG0056HQ
Chemical Name:
Benzenesulfonamide, N,N'-1,5-pentanediylbis[2-nitro-
CAS Number:
832730-54-8
Molecular Formula:
C17H20N4O8S2
Molecular Weight:
472.4927
IUPAC Name:
2-nitro-N-[5-[(2-nitrophenyl)sulfonylamino]pentyl]benzenesulfonamide
InChI:
InChI=1S/C17H20N4O8S2/c22-20(23)14-8-2-4-10-16(14)30(26,27)18-12-6-1-7-13-19-31(28,29)17-11-5-3-9-15(17)21(24)25/h2-5,8-11,18-19H,1,6-7,12-13H2
InChI Key:
BEQVXOHLNIOWLS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1S(=O)(=O)NCCCCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]

Properties

Complexity:
743  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
472.072g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
472.487g/mol
Monoisotopic Mass:
472.072g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
201A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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