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898757-23-8

898757-23-8 structural image
Product Name: 3'-BROMO-4'-CHLORO-4-(5,5-DIMETHYL-1,3-DIOXAN-2-YL)BUTYROPHENONE
Formula: C16H20BrClO3
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COMPUTED DESCRIPTORS

Molecular Weight 375.7 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 374.02843 g/mol
Monoisotopic Mass 374.02843 g/mol
Topological Polar Surface Area 35.5 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 351
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