Home Sulfos 2-bromo-2,2-difluoroethyl trifluoromethanesulfonate

2-bromo-2,2-difluoroethyl trifluoromethanesulfonate

CAS No.:
1989672-35-6
Catalog Number:
AG01B5RK
Molecular Formula:
C3H2BrF5O3S
Molecular Weight:
293.0072
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Product Description
Catalog Number:
AG01B5RK
Chemical Name:
2-bromo-2,2-difluoroethyl trifluoromethanesulfonate
CAS Number:
1989672-35-6
Molecular Formula:
C3H2BrF5O3S
Molecular Weight:
293.0072
MDL Number:
MFCD30342780
IUPAC Name:
(2-bromo-2,2-difluoroethyl) trifluoromethanesulfonate
InChI:
InChI=1S/C3H2BrF5O3S/c4-2(5,6)1-12-13(10,11)3(7,8)9/h1H2
InChI Key:
XWARBAIUQRCYHI-UHFFFAOYSA-N
SMILES:
FC(COS(=O)(=O)C(F)(F)F)(Br)F
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.883g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.002g/mol
Monoisotopic Mass:
291.883g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties