4-[4-[[2-(4-chlorophenyl)-5,5-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]benzoic acid;hydrochloride


Chemical Name: 4-[4-[[2-(4-chlorophenyl)-5,5-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]benzoic acid;hydrochloride
CAS Number: 1305320-63-1
Product Number: AG000UL4(AGN-PC-0JEK35)
Synonyms:
MDL No: MFCD18911741
Molecular Formula: C26H32Cl2N2O2
Molecular Weight: 475.4505

Identification/Properties


Properties
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
475.454g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
474.184g/mol
Monoisotopic Mass:
474.184g/mol
Topological Polar Surface Area:
43.8A^2
Heavy Atom Count:
32
Formal Charge:
0
Complexity:
652
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:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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