Home Sulfos ((Chlorodifluoromethyl);sulfonyl);benzene

((Chlorodifluoromethyl);sulfonyl);benzene

CAS No.:
930836-30-9
Catalog Number:
AG0065Y0
Molecular Formula:
C7H5ClF2O2S
Molecular Weight:
226.6282
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Product Description
Catalog Number:
AG0065Y0
Chemical Name:
((Chlorodifluoromethyl);sulfonyl);benzene
CAS Number:
930836-30-9
Molecular Formula:
C7H5ClF2O2S
Molecular Weight:
226.6282
MDL Number:
MFCD18253567
IUPAC Name:
[chloro(difluoro)methyl]sulfonylbenzene
InChI:
InChI=1S/C7H5ClF2O2S/c8-7(9,10)13(11,12)6-4-2-1-3-5-6/h1-5H
InChI Key:
DZKIZVXCLNLUJF-UHFFFAOYSA-N
SMILES:
FC(S(=O)(=O)c1ccccc1)(Cl)F
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.967g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.622g/mol
Monoisotopic Mass:
225.967g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Literature
Title Journal
Chlorodifluoromethyl phenyl sulfone: a novel non-ozone-depleting substance-based difluorocarbene reagent for O- and N-difluoromethylations. Chemical communications (Cambridge, England) 20071228
Properties