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30751-26-9 | Benzenesulfonamide, 4-chloro-N-(4-methoxyphenyl)-3-nitro-
CAS No: 30751-26-9 Catalog No: AG003156 MDL No:MFCD01269337
Product Description
Catalog Number:
AG003156
Chemical Name:
Benzenesulfonamide, 4-chloro-N-(4-methoxyphenyl)-3-nitro-
CAS Number:
30751-26-9
Molecular Formula:
C13H11ClN2O5S
Molecular Weight:
342.7548
MDL Number:
MFCD01269337
IUPAC Name:
4-chloro-N-(4-methoxyphenyl)-3-nitrobenzenesulfonamide
InChI:
InChI=1S/C13H11ClN2O5S/c1-21-10-4-2-9(3-5-10)15-22(19,20)11-6-7-12(14)13(8-11)16(17)18/h2-8,15H,1H3
InChI Key:
ZARAKCIKPBGLMM-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])Cl
Properties
Complexity:
482
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.008g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
342.75g/mol
Monoisotopic Mass:
342.008g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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