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Home > Nitro Compounds > 158729-25-0
158729-25-0 | 8-Quinolinesulfonamide, N-(3-nitrophenyl)-
CAS No: 158729-25-0 Catalog No: AG001QSS MDL No:
Product Description
Catalog Number:
AG001QSS
Chemical Name:
8-Quinolinesulfonamide, N-(3-nitrophenyl)-
CAS Number:
158729-25-0
Molecular Formula:
C15H11N3O4S
Molecular Weight:
329.3305
IUPAC Name:
N-(3-nitrophenyl)quinoline-8-sulfonamide
InChI:
InChI=1S/C15H11N3O4S/c19-18(20)13-7-2-6-12(10-13)17-23(21,22)14-8-1-4-11-5-3-9-16-15(11)14/h1-10,17H
InChI Key:
ACTSYSYEGYKYCS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)NS(=O)(=O)c1cccc2c1nccc2
Properties
Complexity:
528
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.047g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
329.33g/mol
Monoisotopic Mass:
329.047g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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