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Home Sulfos 2-Amino-5-chloro-4-methylbenzenesulfonic acid

2-Amino-5-chloro-4-methylbenzenesulfonic acid

CAS No.:
88-53-9
Catalog Number:
AG004E5J
Molecular Formula:
C7H8ClNO3S
Molecular Weight:
221.6613
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$32
- +
25g
95%
In Stock USA
United States
$79
- +
100g
95%
In Stock USA
United States
$225
- +
500g
95%
In Stock USA
United States
$513
- +
Product Description
Catalog Number:
AG004E5J
Chemical Name:
2-Amino-5-chloro-4-methylbenzenesulfonic acid
CAS Number:
88-53-9
Molecular Formula:
C7H8ClNO3S
Molecular Weight:
221.6613
MDL Number:
MFCD00043924
IUPAC Name:
2-amino-5-chloro-4-methylbenzenesulfonic acid
InChI:
InChI=1S/C7H8ClNO3S/c1-4-2-6(9)7(3-5(4)8)13(10,11)12/h2-3H,9H2,1H3,(H,10,11,12)
InChI Key:
VYZCFAPUHSSYCC-UHFFFAOYSA-N
SMILES:
Cc1cc(Cl)c(cc1N)S(=O)(=O)O
EC Number:
201-839-7
UNII:
HNF96511X2
Properties
Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.991g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
221.655g/mol
Monoisotopic Mass:
220.991g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
88.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
2-Ammonio-5-chloro-4-methylbenzenesulfonate, its 1-methyl-2-pyrrolidone and dimethyl sulfoxide monosolvates and a corrected structure of 2,2'-(1,4-phenylene)di(4,5-dihydroimidazolium) bis(4-aminobenzenesulfonate) dihydrate. Acta crystallographica. Section C, Crystal structure communications 20120201
Removal of 5-amino-2-chlorotoluene-4-sulfonic and chlorhydric acids from wastewater by weakly basic resin: equilibrium and kinetics. Biomedical and environmental sciences : BES 20071001
Properties