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87317-04-2 | Benzenesulfonamide, N-(2,5-dichlorophenyl)-3-nitro-
CAS No: 87317-04-2 Catalog No: AG004OPO MDL No:
Product Description
Catalog Number:
AG004OPO
Chemical Name:
Benzenesulfonamide, N-(2,5-dichlorophenyl)-3-nitro-
CAS Number:
87317-04-2
Molecular Formula:
C12H8Cl2N2O4S
Molecular Weight:
347.1739
IUPAC Name:
N-(2,5-dichlorophenyl)-3-nitrobenzenesulfonamide
InChI:
InChI=1S/C12H8Cl2N2O4S/c13-8-4-5-11(14)12(6-8)15-21(19,20)10-3-1-2-9(7-10)16(17)18/h1-7,15H
InChI Key:
SDUIIMOXRUBDPQ-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)NS(=O)(=O)c1cccc(c1)[N+](=O)[O-])Cl
Properties
Complexity:
477
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.958g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
347.166g/mol
Monoisotopic Mass:
345.958g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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