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88-50-6

88-50-6 | 4-Amino-2,5-dichlorobenzenesulfonic acid

CAS No: 88-50-6 Catalog No: AG003KO5 MDL No:MFCD00025159

Product Description

Catalog Number:
AG003KO5
Chemical Name:
4-Amino-2,5-dichlorobenzenesulfonic acid
CAS Number:
88-50-6
Molecular Formula:
C6H5Cl2NO3S
Molecular Weight:
242.0798
MDL Number:
MFCD00025159
IUPAC Name:
4-amino-2,5-dichlorobenzenesulfonic acid
InChI:
InChI=1S/C6H5Cl2NO3S/c7-3-2-6(13(10,11)12)4(8)1-5(3)9/h1-2H,9H2,(H,10,11,12)
InChI Key:
SJCTXIKOXTUQHC-UHFFFAOYSA-N
SMILES:
Clc1cc(c(cc1N)Cl)S(=O)(=O)O
EC Number:
201-836-0

Properties

Complexity:
276  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.937g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
242.07g/mol
Monoisotopic Mass:
240.937g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
88.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

Literature

Title Journal
Influence of anionic sulfonate-containing and nitrogen-containing mixed-ligands on the structures of silver coordination polymers. Dalton transactions (Cambridge, England : 2003) 20090507
Influence of anionic sulfonate-containing co-ligands on the solid structures of silver complexes supported by 4,4'-bipyridine bridges. Dalton transactions (Cambridge, England : 2003) 20081021
Bis[μ-1,2-bis-(1H-imidazol-1-ylmethyl)benzene-κN:N]disilver(I) bis-(4-amino-2,5-dichloro-benzene-sulfonate) tetra-hydrate. Acta crystallographica. Section E, Structure reports online 20080801

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