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2070-48-6 | Benzenesulfonamide, 4-[(trifluoromethyl)sulfonyl]-
CAS No: 2070-48-6 Catalog No: AG002IT1 MDL No:
Product Description
Catalog Number:
AG002IT1
Chemical Name:
Benzenesulfonamide, 4-[(trifluoromethyl)sulfonyl]-
CAS Number:
2070-48-6
Molecular Formula:
C7H6F3NO4S2
Molecular Weight:
289.2520
IUPAC Name:
4-(trifluoromethylsulfonyl)benzenesulfonamide
InChI:
InChI=1S/C7H6F3NO4S2/c8-7(9,10)16(12,13)5-1-3-6(4-2-5)17(11,14)15/h1-4H,(H2,11,14,15)
InChI Key:
UIMYKAIGUAXWCJ-UHFFFAOYSA-N
SMILES:
FC(S(=O)(=O)c1ccc(cc1)S(=O)(=O)N)(F)F
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.969g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.243g/mol
Monoisotopic Mass:
288.969g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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