Home Sulfos 4-chloro-N-(2,4-dimethylphenyl)-3-nitrobenzene-1-sulfonamide

4-chloro-N-(2,4-dimethylphenyl)-3-nitrobenzene-1-sulfonamide

CAS No.:
292867-27-7
Catalog Number:
AG019GWJ
Molecular Formula:
C14H13ClN2O4S
Molecular Weight:
340.7820
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Product Description
Catalog Number:
AG019GWJ
Chemical Name:
4-chloro-N-(2,4-dimethylphenyl)-3-nitrobenzene-1-sulfonamide
CAS Number:
292867-27-7
Molecular Formula:
C14H13ClN2O4S
Molecular Weight:
340.7820
MDL Number:
MFCD01269334
IUPAC Name:
4-chloro-N-(2,4-dimethylphenyl)-3-nitrobenzenesulfonamide
InChI:
InChI=1S/C14H13ClN2O4S/c1-9-3-6-13(10(2)7-9)16-22(20,21)11-4-5-12(15)14(8-11)17(18)19/h3-8,16H,1-2H3
InChI Key:
TWYKCUHKBHKOHK-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C)NS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])Cl
Properties
Complexity:
502  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.028g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
340.778g/mol
Monoisotopic Mass:
340.028g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties