Home Sulfos 4-(Methylsulfonyl)-2-nitroaniline

4-(Methylsulfonyl)-2-nitroaniline

CAS No.:
21731-56-6
Catalog Number:
AG003K98
Molecular Formula:
C7H8N2O4S
Molecular Weight:
216.2144
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$110
- +
5g
95%
In Stock USA
United States
$275
- +
10g
95%
In Stock USA
United States
$425
- +
25g
95%
In Stock USA
United States
$1025
- +
Product Description
Catalog Number:
AG003K98
Chemical Name:
4-(Methylsulfonyl)-2-nitroaniline
CAS Number:
21731-56-6
Molecular Formula:
C7H8N2O4S
Molecular Weight:
216.2144
MDL Number:
MFCD00718367
IUPAC Name:
4-methylsulfonyl-2-nitroaniline
InChI:
InChI=1S/C7H8N2O4S/c1-14(12,13)5-2-3-6(8)7(4-5)9(10)11/h2-4H,8H2,1H3
InChI Key:
NDZFWKZHVAUUTN-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1N)S(=O)(=O)C
EC Number:
244-550-1
Properties
Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.02g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.211g/mol
Monoisotopic Mass:
216.02g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
114A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties