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898782-91-7

898782-91-7 structural image
Product Name: 4-(5,5-DIMETHYL-1,3-DIOXAN-2-YL)-3'-PHENOXYBUTYROPHENONE
Formula: C22H26O4
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COMPUTED DESCRIPTORS

Molecular Weight 354.4 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 7
Exact Mass 354.18310931 g/mol
Monoisotopic Mass 354.18310931 g/mol
Topological Polar Surface Area 44.8 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 431
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