Home Sulfos 4-Methanesulfonyl-2-methyl-1-nitrobenzene

4-Methanesulfonyl-2-methyl-1-nitrobenzene

CAS No.:
252561-99-2
Catalog Number:
AG00I4TN
Molecular Formula:
C8H9NO4S
Molecular Weight:
215.2264
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$125
- +
5g
98%
In Stock USA
United States
$438
- +
10g
98%
In Stock USA
United States
$800
- +
Product Description
Catalog Number:
AG00I4TN
Chemical Name:
4-Methanesulfonyl-2-methyl-1-nitrobenzene
CAS Number:
252561-99-2
Molecular Formula:
C8H9NO4S
Molecular Weight:
215.2264
MDL Number:
MFCD12407099
IUPAC Name:
2-methyl-4-methylsulfonyl-1-nitrobenzene
InChI:
InChI=1S/C8H9NO4S/c1-6-5-7(14(2,12)13)3-4-8(6)9(10)11/h3-5H,1-2H3
InChI Key:
YEONDRKRXPDGTJ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1C)S(=O)(=O)C
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.025g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.223g/mol
Monoisotopic Mass:
215.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties