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156497-87-9

156497-87-9 structural image
Product Name: (4-TRIFLUOROMETHYLBENZENESULFONYL)-ACETIC ACID
Formula: C9H6F3O4S-
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COMPUTED DESCRIPTORS

Molecular Weight 268.21 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 268.00171436 g/mol
Monoisotopic Mass 268.00171436 g/mol
Topological Polar Surface Area 79.8 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 374
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes