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410086-28-1

410086-28-1 structural image
Product Name: 7-(trifluoroMethyl)isoquinolin-1(2H)-one
Formula: C10H6F3NO
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COMPUTED DESCRIPTORS

Molecular Weight 213.16 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 213.04014830 g/mol
Monoisotopic Mass 213.04014830 g/mol
Topological Polar Surface Area 29.1 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 298
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