Home Sulfos 3-Chloro-4-(methylsulfonyl)nitrobenzene

3-Chloro-4-(methylsulfonyl)nitrobenzene

CAS No.:
91842-77-2
Catalog Number:
AG003J7Q
Molecular Formula:
C7H6ClNO4S
Molecular Weight:
235.6448
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$75
- +
5g
95%
In Stock USA
United States
$225
- +
10g
95%
In Stock USA
United States
$350
- +
25g
95%
In Stock USA
United States
$737
- +
Product Description
Catalog Number:
AG003J7Q
Chemical Name:
3-Chloro-4-(methylsulfonyl)nitrobenzene
CAS Number:
91842-77-2
Molecular Formula:
C7H6ClNO4S
Molecular Weight:
235.6448
MDL Number:
MFCD08692409
IUPAC Name:
2-chloro-1-methylsulfonyl-4-nitrobenzene
InChI:
InChI=1S/C7H6ClNO4S/c1-14(12,13)7-3-2-5(9(10)11)4-6(7)8/h2-4H,1H3
InChI Key:
DMNZSCLCCLDNPZ-UHFFFAOYSA-N
SMILES:
Clc1cc(ccc1S(=O)(=O)C)[N+](=O)[O-]
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.971g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.638g/mol
Monoisotopic Mass:
234.971g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties