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312277-49-9

312277-49-9 structural image
Product Name: ethyl 3,3,3-trifluoro-2-hydroxy-2-(3-methoxy-4-(perfluorobenzamido)phenyl)propanoate
Formula: C19H13F8NO5
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COMPUTED DESCRIPTORS

Molecular Weight 487.3 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 7
Exact Mass 487.06659781 g/mol
Monoisotopic Mass 487.06659781 g/mol
Topological Polar Surface Area 84.9 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 696
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes