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1024074-55-2

1024074-55-2 structural image
Product Name: 2-BROMO-5,5-DIMETHYL-3-((4-(TRIFLUOROMETHOXY)PHENYL)AMINO)CYCLOHEX-2-EN-1-ONE
Formula: C15H15BrF3NO2
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COMPUTED DESCRIPTORS

Molecular Weight 378.18 g/mol
XLogP3 5.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 377.02383 g/mol
Monoisotopic Mass 377.02383 g/mol
Topological Polar Surface Area 38.3 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 466
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