4-Piperidinol, 4-(p-chlorophenyl)-1-(3-(2-(p-fluorophenyl)-1,3-dioxolan-2-yl)propyl)-

Base Information

Chemical Name:4-Piperidinol, 4-(p-chlorophenyl)-1-(3-(2-(p-fluorophenyl)-1,3-dioxolan-2-yl)propyl)-
CAS No.:56660-99-2
Molecular Formula:C23H27 Cl F N O3
Molecular Weight:419.924
Hs Code.:
DSSTox Substance ID:DTXSID30205228
Nikkaji Number:J23.943G
Wikidata:Q83078729

Synonyms:56660-99-2;BRN 1514587;4-Piperidinol, 4-(p-chlorophenyl)-1-(3-(2-(p-fluorophenyl)-1,3-dioxolan-2-yl)propyl)-;4-(4-chlorophenyl)-1-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propyl]piperidin-4-ol;4-(4-(p-Chlorophenyl)-4-hydroxypiperidino)-1,1-ethylenedioxy-1-(p-fluorophenyl)butane;4-(p-Chlorophenyl)-1-(3-(2-(p-fluorophenyl)-1,3-dioxolan-2-yl)propyl)-4-piperidinol;C23H27ClFNO3;DTXSID30205228;LS-116918;4-(p-Chlorophenyl)-1-[4,4-(ethylenebisoxy)-4-(p-fluorophenyl)butyl]-4-piperidinol

Suppliers and Price of 4-Piperidinol, 4-(p-chlorophenyl)-1-(3-(2-(p-fluorophenyl)-1,3-dioxolan-2-yl)propyl)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
4-(4-Chlorophenyl)-1-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propyl]-4-piperidinol
5mg
$ 185.00

American Custom Chemicals Corporation
4-(P-CHLOROPHENYL)-1-(3-(2-(P-FLUOROPHENYL)-1,3-DIOXOLAN-2-YL)PROPYL)-4-PIPERIDINOL 95.00%
5MG
$ 496.09

Total 1 raw suppliers

Chemical Property of 4-Piperidinol, 4-(p-chlorophenyl)-1-(3-(2-(p-fluorophenyl)-1,3-dioxolan-2-yl)propyl)-

Chemical Property:

Vapor Pressure:6.83E-13mmHg at 25°C
Boiling Point:549.1°Cat760mmHg
PKA:13.87±0.20(Predicted)
Flash Point:285.9°C
PSA：41.93000
Density:1.246g/cm³
LogP:4.38040
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:419.1663496
Heavy Atom Count:29
Complexity:506

Purity/Quality:

99% ^*data from raw suppliers

4-(4-Chlorophenyl)-1-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propyl]-4-piperidinol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCC3(OCCO3)C4=CC=C(C=C4)F
Uses 4-(4-Chlorophenyl)-1-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propyl]-4-piperidinol is an intermediate used in the synthesis of O-(1-(4-Fluorophenyl)butan-1-one) Haloperidol (F596225), which is an impurity of Haloperidol (H103700), an antidyskinetic; antipsychotic.

Technology Process of 4-Piperidinol, 4-(p-chlorophenyl)-1-(3-(2-(p-fluorophenyl)-1,3-dioxolan-2-yl)propyl)-

There total 5 articles about 4-Piperidinol, 4-(p-chlorophenyl)-1-(3-(2-(p-fluorophenyl)-1,3-dioxolan-2-yl)propyl)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 78.0%

: 39512-49-7
4-(4-chlorophenyl)-4-hydroxypiperidine

: 847025-06-3
3-[2-(4-fluorophenyl)-[1,3]dioxolan-2-yl]propionaldehyde

: 56660-99-2
4-<4-(4-chlorophenyl)-4-hydroxypiperidino>-1,1-ethylenedioxy-1-(4-fluorophenyl)butane

Guidance literature:: With sodium cyanoborohydride; acetic acid; In methanol; at 20 ℃; for 30h;
DOI:10.1002/adsc.200404123

Reference yield:

: 39512-49-7
4-(4-chlorophenyl)-4-hydroxypiperidine

: 3308-94-9
4-chloro-1-(4-fluorophenyl)-1,1-(ethylenedioxy)butane

: 56660-99-2
4-<4-(4-chlorophenyl)-4-hydroxypiperidino>-1,1-ethylenedioxy-1-(4-fluorophenyl)butane

Guidance literature:: With potassium carbonate; potassium iodide; In N,N-dimethyl-formamide; at 100 ℃; for 17.5h;
DOI:10.1021/jm00147a035

Reference yield:

: 3874-54-2,41167-07-1
4-(4-fluorophenyl)-4-oxo-n-butyl chloride

: 56660-99-2
4-<4-(4-chlorophenyl)-4-hydroxypiperidino>-1,1-ethylenedioxy-1-(4-fluorophenyl)butane

Guidance literature:: Multi-step reaction with 2 steps

1: p-toluenesulfonic acid / benzene / 12 h / Heating

2: K₂CO₃, KI / dimethylformamide / 17.5 h / 100 °C

With potassium carbonate; toluene-4-sulfonic acid; potassium iodide; In N,N-dimethyl-formamide; benzene;
DOI:10.1021/jm00147a035