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898786-51-1

898786-51-1 structural image
Product Name: 5-(5,5-DIMETHYL-1,3-DIOXAN-2-YL)-3'-METHOXYVALEROPHENONE
Formula: C18H26O4
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COMPUTED DESCRIPTORS

Molecular Weight 306.4 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 7
Exact Mass 306.18310931 g/mol
Monoisotopic Mass 306.18310931 g/mol
Topological Polar Surface Area 44.8 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 343
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