1-Butanone,4-[4-(4-bromophenyl)-4-hydroxy-1-piperidinyl]-1-(4-fluorophenyl)-


Chemical Name: 1-Butanone,4-[4-(4-bromophenyl)-4-hydroxy-1-piperidinyl]-1-(4-fluorophenyl)-
CAS Number: 10457-90-6
Product Number: AG008SDG(AGN-PC-0OTJXQ)
Synonyms:
MDL No:
Molecular Formula: C21H23BrFNO2
Molecular Weight: 420.3152

Identification/Properties


Computed Properties
Molecular Weight:
420.322g/mol
XLogP3:
3.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
419.09g/mol
Monoisotopic Mass:
419.09g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
451
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

Safety Information


NMR Spectrum


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