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Homecas926206-54-4

926206-54-4

926206-54-4 structural image
Product Name: Propanoic acid, 2-[4-(3-oxobutyl)phenoxy]-
Formula: C13H16O4
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COMPUTED DESCRIPTORS

Molecular Weight 236.26 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 236.10485899 g/mol
Monoisotopic Mass 236.10485899 g/mol
Topological Polar Surface Area 63.6 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 267
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