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1393442-28-8

1393442-28-8 structural image
Product Name: tert-butyl N-[4-broMo-2-(trifluoroMethyl)phenyl]carbaMate
Formula: C12H13BrF3NO2
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COMPUTED DESCRIPTORS

Molecular Weight 340.14 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 339.00818 g/mol
Monoisotopic Mass 339.00818 g/mol
Topological Polar Surface Area 38.3 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 328
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