Home Sulfos 3,4-Dichloroaniline-6-sulfonic acid

3,4-Dichloroaniline-6-sulfonic acid

CAS No.:
6331-96-0
Catalog Number:
AG003GED
Molecular Formula:
C6H5Cl2NO3S
Molecular Weight:
242.0798
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$19
- +
5g
95%
In Stock USA
United States
$44
- +
25g
95%
In Stock USA
United States
$124
- +
Product Description
Catalog Number:
AG003GED
Chemical Name:
3,4-Dichloroaniline-6-sulfonic acid
CAS Number:
6331-96-0
Molecular Formula:
C6H5Cl2NO3S
Molecular Weight:
242.0798
MDL Number:
MFCD00036096
IUPAC Name:
2-amino-4,5-dichlorobenzenesulfonic acid
InChI:
InChI=1S/C6H5Cl2NO3S/c7-3-1-5(9)6(2-4(3)8)13(10,11)12/h1-2H,9H2,(H,10,11,12)
InChI Key:
AKLDPNVZTZIVFA-UHFFFAOYSA-N
SMILES:
Nc1cc(Cl)c(cc1S(=O)(=O)O)Cl
NSC Number:
37399
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:
1.8  
Properties