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22953-42-0

22953-42-0 structural image
Product Name: Phenol, p-(bis(2-bromoethyl)amino)-, p-(alpha,alpha,alpha-trifluoromet hyl)benzoate
Formula: C18H16Br2F3NO2
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COMPUTED DESCRIPTORS

Molecular Weight 495.1 g/mol
XLogP3 5.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 8
Exact Mass 494.94794 g/mol
Monoisotopic Mass 492.94999 g/mol
Topological Polar Surface Area 29.5 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 429
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