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898752-37-9

898752-37-9 structural image
Product Name: ETHYL 5-(3,5-DIFLUOROPHENYL)-5-OXOVALERATE
Formula: C13H14F2O3
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COMPUTED DESCRIPTORS

Molecular Weight 256.24 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 7
Exact Mass 256.09110063 g/mol
Monoisotopic Mass 256.09110063 g/mol
Topological Polar Surface Area 43.4 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 284
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