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Homecas898766-08-0

898766-08-0

898766-08-0 structural image
Product Name: 2,2-DIMETHYL-3',4',5'-TRIFLUOROBUTYROPHENONE
Formula: C12H13F3O
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COMPUTED DESCRIPTORS

Molecular Weight 230.23 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 230.09184952 g/mol
Monoisotopic Mass 230.09184952 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 253
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