Home Sulfos 2-Nitro-4-(trifluoromethylsulfonyl)chlorobenzene

2-Nitro-4-(trifluoromethylsulfonyl)chlorobenzene

CAS No.:
1550-27-2
Catalog Number:
AG001NJE
Molecular Formula:
C7H3ClF3NO4S
Molecular Weight:
289.6162
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$313
- +
5g
95%
In Stock USA
United States
$938
- +
10g
95%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG001NJE
Chemical Name:
2-Nitro-4-(trifluoromethylsulfonyl)chlorobenzene
CAS Number:
1550-27-2
Molecular Formula:
C7H3ClF3NO4S
Molecular Weight:
289.6162
MDL Number:
MFCD00435125
IUPAC Name:
1-chloro-2-nitro-4-(trifluoromethylsulfonyl)benzene
InChI:
InChI=1S/C7H3ClF3NO4S/c8-5-2-1-4(3-6(5)12(13)14)17(15,16)7(9,10)11/h1-3H
InChI Key:
BDIMBZRJVHLTPD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)C(F)(F)F
Properties
Complexity:
399  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.942g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.609g/mol
Monoisotopic Mass:
288.942g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
88.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties