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898758-99-1

898758-99-1 structural image
Product Name: ETHYL 4-(2-METHYL-5-FLUOROPHENYL)-4-OXOBUTYRATE
Formula: C13H15FO3
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COMPUTED DESCRIPTORS

Molecular Weight 238.25 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 238.10052250 g/mol
Monoisotopic Mass 238.10052250 g/mol
Topological Polar Surface Area 43.4 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 278
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