22953-42-0
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 |