Home Sulfos 1-(bromomethyl)-3-trifluoromethanesulfonylbenzene

1-(bromomethyl)-3-trifluoromethanesulfonylbenzene

CAS No.:
866208-07-3
Catalog Number:
AG01C1DX
Molecular Formula:
C8H6BrF3O2S
Molecular Weight:
303.0962
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Product Description
Catalog Number:
AG01C1DX
Chemical Name:
1-(bromomethyl)-3-trifluoromethanesulfonylbenzene
CAS Number:
866208-07-3
Molecular Formula:
C8H6BrF3O2S
Molecular Weight:
303.0962
MDL Number:
MFCD14706281
IUPAC Name:
1-(bromomethyl)-3-(trifluoromethylsulfonyl)benzene
InChI:
InChI=1S/C8H6BrF3O2S/c9-5-6-2-1-3-7(4-6)15(13,14)8(10,11)12/h1-4H,5H2
InChI Key:
CSEJNPDLDAEZQZ-UHFFFAOYSA-N
SMILES:
BrCc1cccc(c1)S(=O)(=O)C(F)(F)F
Properties
Complexity:
307  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.922g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.093g/mol
Monoisotopic Mass:
301.922g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties