Home Sulfos 2-Chloro-1-methanesulfonyl-4-(trifluoromethyl)benzene

2-Chloro-1-methanesulfonyl-4-(trifluoromethyl)benzene

CAS No.:
1000339-68-3
Catalog Number:
AG0094A5
Molecular Formula:
C8H6ClF3O2S
Molecular Weight:
258.6452
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$219
- +
5g
98%
In Stock USA
United States
$844
- +
Product Description
Catalog Number:
AG0094A5
Chemical Name:
2-Chloro-1-methanesulfonyl-4-(trifluoromethyl)benzene
CAS Number:
1000339-68-3
Molecular Formula:
C8H6ClF3O2S
Molecular Weight:
258.6452
MDL Number:
MFCD09264544
IUPAC Name:
2-chloro-1-methylsulfonyl-4-(trifluoromethyl)benzene
InChI:
InChI=1S/C8H6ClF3O2S/c1-15(13,14)7-3-2-5(4-6(7)9)8(10,11)12/h2-4H,1H3
InChI Key:
ZNAYXQXSMUXTSB-UHFFFAOYSA-N
SMILES:
Clc1cc(ccc1S(=O)(=O)C)C(F)(F)F
Properties
Complexity:
320  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.973g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.639g/mol
Monoisotopic Mass:
257.973g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties