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99437-70-4

99437-70-4 structural image
Product Name: Ethyl 3-hydroxy-4,4,4-trifluorobutyrate
Formula: C6H9F3O3
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COMPUTED DESCRIPTORS

Molecular Weight 186.13 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 186.05037863 g/mol
Monoisotopic Mass 186.05037863 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 155
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes