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338953-89-2

338953-89-2 structural image
Product Name: 2-[(2-OXO-2-([3-(TRIFLUOROMETHYL)BENZYL]AMINO)ETHYL)SULFONYL]ACETIC ACID
Formula: C12H12F3NO5S
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COMPUTED DESCRIPTORS

Molecular Weight 339.29 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 6
Exact Mass 339.03882814 g/mol
Monoisotopic Mass 339.03882814 g/mol
Topological Polar Surface Area 109 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 512
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

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