Home Halogens 4-Chloro-3-(4-chloro-phenylsulfamoyl)-benzoic acid

4-Chloro-3-(4-chloro-phenylsulfamoyl)-benzoic acid

CAS No.:
325724-62-7
Catalog Number:
AG00I665
Molecular Formula:
C13H9Cl2NO4S
Molecular Weight:
346.1859
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Product Description
Catalog Number:
AG00I665
Chemical Name:
4-Chloro-3-(4-chloro-phenylsulfamoyl)-benzoic acid
CAS Number:
325724-62-7
Molecular Formula:
C13H9Cl2NO4S
Molecular Weight:
346.1859
MDL Number:
MFCD01122312
IUPAC Name:
4-chloro-3-[(4-chlorophenyl)sulfamoyl]benzoic acid
InChI:
InChI=1S/C13H9Cl2NO4S/c14-9-2-4-10(5-3-9)16-21(19,20)12-7-8(13(17)18)1-6-11(12)15/h1-7,16H,(H,17,18)
InChI Key:
OHSURHKNUAUYHW-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)NS(=O)(=O)c1cc(ccc1Cl)C(=O)O
Properties
Complexity:
471  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.963g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
346.178g/mol
Monoisotopic Mass:
344.963g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties