Home Sulfos 1-(Ethanesulfonyl)-2-nitrobenzene

1-(Ethanesulfonyl)-2-nitrobenzene

CAS No.:
2976-33-2
Catalog Number:
AG00BIGW
Molecular Formula:
C8H9NO4S
Molecular Weight:
215.2264
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$100
- +
5g
97%
In Stock USA
United States
$300
- +
10g
97%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG00BIGW
Chemical Name:
1-(Ethanesulfonyl)-2-nitrobenzene
CAS Number:
2976-33-2
Molecular Formula:
C8H9NO4S
Molecular Weight:
215.2264
MDL Number:
MFCD24448798
IUPAC Name:
1-ethylsulfonyl-2-nitrobenzene
InChI:
InChI=1S/C8H9NO4S/c1-2-14(12,13)8-6-4-3-5-7(8)9(10)11/h3-6H,2H2,1H3
InChI Key:
PMKYHQJHNPJUGQ-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)c1ccccc1[N+](=O)[O-]
Properties
Complexity:
300  
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:
2  
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties