Home Sulfos 1-Bromo-4-[(trifluoromethyl)sulfonyl]benzene

1-Bromo-4-[(trifluoromethyl)sulfonyl]benzene

CAS No.:
312-20-9
Catalog Number:
AG00C26Q
Molecular Formula:
C7H4BrF3O2S
Molecular Weight:
289.0697
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Product Description
Catalog Number:
AG00C26Q
Chemical Name:
1-Bromo-4-[(trifluoromethyl)sulfonyl]benzene
CAS Number:
312-20-9
Molecular Formula:
C7H4BrF3O2S
Molecular Weight:
289.0697
MDL Number:
MFCD00474580
IUPAC Name:
1-bromo-4-(trifluoromethylsulfonyl)benzene
InChI:
InChI=1S/C7H4BrF3O2S/c8-5-1-3-6(4-2-5)14(12,13)7(9,10)11/h1-4H
InChI Key:
BRNFLBCPGQCBQQ-UHFFFAOYSA-N
SMILES:
FC(S(=O)(=O)c1ccc(cc1)Br)(F)F
NSC Number:
174223
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.907g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.066g/mol
Monoisotopic Mass:
287.907g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties