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82027-57-4

82027-57-4 structural image
Product Name: Benzeneacetic acid, α-(2,2,2-trifluoroethoxy)-
Formula: C10H9F3O3
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COMPUTED DESCRIPTORS

Molecular Weight 234.17 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 234.05037863 g/mol
Monoisotopic Mass 234.05037863 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 234
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