Home Sulfos 1-(Ethanesulfonyl)-4-nitro-2-(trifluoromethyl)benzene

1-(Ethanesulfonyl)-4-nitro-2-(trifluoromethyl)benzene

CAS No.:
1820615-46-0
Catalog Number:
AG00I0JN
Molecular Formula:
C9H8F3NO4S
Molecular Weight:
283.2243
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$188
- +
5g
95%
In Stock USA
United States
$700
- +
Product Description
Catalog Number:
AG00I0JN
Chemical Name:
1-(Ethanesulfonyl)-4-nitro-2-(trifluoromethyl)benzene
CAS Number:
1820615-46-0
Molecular Formula:
C9H8F3NO4S
Molecular Weight:
283.2243
MDL Number:
MFCD25953910
IUPAC Name:
1-ethylsulfonyl-4-nitro-2-(trifluoromethyl)benzene
InChI:
InChI=1S/C9H8F3NO4S/c1-2-18(16,17)8-4-3-6(13(14)15)5-7(8)9(10,11)12/h3-5H,2H2,1H3
InChI Key:
GAIJSHXMSSLUTC-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)c1ccc(cc1C(F)(F)F)[N+](=O)[O-]
Properties
Complexity:
409  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.013g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.221g/mol
Monoisotopic Mass:
283.013g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties