Home Sulfos 1-Bromo-2-methanesulfonyl-4-nitro-5-(trifluoromethoxy)benzene

1-Bromo-2-methanesulfonyl-4-nitro-5-(trifluoromethoxy)benzene

CAS No.:
1403483-61-3
Catalog Number:
AG009WXG
Molecular Formula:
C8H5BrF3NO5S
Molecular Weight:
364.0932
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$75
- +
5g
96%
In Stock USA
United States
$225
- +
10g
96%
In Stock USA
United States
$350
- +
25g
96%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG009WXG
Chemical Name:
1-Bromo-2-methanesulfonyl-4-nitro-5-(trifluoromethoxy)benzene
CAS Number:
1403483-61-3
Molecular Formula:
C8H5BrF3NO5S
Molecular Weight:
364.0932
MDL Number:
MFCD22549344
IUPAC Name:
1-bromo-2-methylsulfonyl-4-nitro-5-(trifluoromethoxy)benzene
InChI:
InChI=1S/C8H5BrF3NO5S/c1-19(16,17)7-3-5(13(14)15)6(2-4(7)9)18-8(10,11)12/h2-3H,1H3
InChI Key:
KCHRASZRDOIERM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(c(cc1OC(F)(F)F)Br)S(=O)(=O)C
Properties
Complexity:
443  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.902g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
364.089g/mol
Monoisotopic Mass:
362.902g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties