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Home > Encyclopedia > 4-[4-(4-Chlorophenyl-d4)-4-hydroxy-1-piperidinyl]-1-(2-fluorophenyl)-1-butanone

4-[4-(4-Chlorophenyl-d4)-4-hydroxy-1-piperidinyl]-1-(2-fluorophenyl)-1-butanone

4-[4-(4-Chlorophenyl-d4)-4-hydroxy-1-piperidinyl]-1-(2-fluorophenyl)-1-butanone structure

4-[4-(4-Chlorophenyl-d4)-4-hydroxy-1-piperidinyl]-1-(2-fluorophenyl)-1-butanone 

structure
  • CAS No:

    1795021-11-2

  • Formula:

    C21H19ClD4FNO2

  • Chemical Name:

    4-[4-(4-Chlorophenyl-d4)-4-hydroxy-1-piperidinyl]-1-(2-fluorophenyl)-1-butanone

  • Synonyms:

    4-Defluoro-2-fluoro Haloperidol-d4

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

4-[4-(4-Chlorophenyl-d4)-4-hydroxy-1-piperidinyl]-1-(2-fluorophenyl)-1-butanone Basic Attributes

379.888870312

379.165

Characteristics

40.5

3.2

4-[4-(4-Chlorophenyl-d4)-4-hydroxy-1-piperidinyl]-1-(2-fluorophenyl)-1-butanone Use and Manufacturing

Labelled analogue of 4-Defluoro-2-fluoro Haloperidol, a positional isomer and impurity of the antipsychotic agent Haloperidol (H103700).

Computed Properties

Molecular Weight:379.9
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:379.1652418
Monoisotopic Mass:379.1652418
Topological Polar Surface Area:40.5
Heavy Atom Count:26
Complexity:459
Isotope Atom Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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