1-Benzyl-4-(4-chlorophenyl)piperidin-4-ol

Base Information

• Chemical Name: 1-Benzyl-4-(4-chlorophenyl)piperidin-4-ol
• CAS No.: 56108-25-9
• Molecular Formula: C18H20ClNO
• Molecular Weight: 301.816
• ChEMBL ID: CHEMBL419244
• DSSTox Substance ID: DTXSID10579297
• Nikkaji Number: J31.372F
• Wikidata: Q72440927
• Mol file: 56108-25-9.mol

Synonyms:56108-25-9;1-benzyl-4-(4-chlorophenyl)piperidin-4-ol;N-Benzyl-4-(p-chlorophenyl)-4-piperidinol;CHEMBL419244;1-Benzyl-4-(p-chlorophenyl)-4-piperidinol;1-Benzyl-4-(4-chloro-phenyl)-piperidin-4-ol;n-benzyl-4-(4-chlorophenyl)-4-hydroxypiperidine;SCHEMBL653218;DTXSID10579297;NGJGWNDBSJUZQU-UHFFFAOYSA-N;BDBM50117477;AKOS015899103;A8077

Chemical Property of 1-Benzyl-4-(4-chlorophenyl)piperidin-4-ol

Chemical Property:

• Vapor Pressure: 8.58E-09mmHg at 25°C
• Refractive Index: 1.617
• Boiling Point: 447.5 °C at 760 mmHg
• Flash Point: 224.5 °C
• PSA: 23.47000
• Density: 1.22 g/cm³
• LogP: 3.76150
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 301.1233420
• Heavy Atom Count: 21
• Complexity: 313

Purity/Quality:

97% ^*data from raw suppliers

1-BENZYL-4-(4-CHLOROPHENYL)-4-PIPERIDINOL 95.00% ^*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)CC3=CC=CC=C3

Technology Process of 1-Benzyl-4-(4-chlorophenyl)piperidin-4-ol

There total 7 articles about 1-Benzyl-4-(4-chlorophenyl)piperidin-4-ol 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: 97.0%

4-(4-chlorophenyl)-4-hydroxypiperidine (39512-49-7) + benzyl bromide (100-39-0) → N-benzyl-4-(4-chlorophenyl)-4-hydroxypiperidin (56108-25-9)

Guidance literature:

With N-benzyl-trimethylammonium hydroxide; at 20 ℃; Neat (no solvent);

DOI:10.1080/00397910802654740

Reference yield: 90.0%

bromochlorobenzene (106-39-8) + N-benzyl-2-piperidinone (4783-65-7) → N-benzyl-4-(4-chlorophenyl)-4-hydroxypiperidin (56108-25-9)

Guidance literature:

bromochlorobenzene; With iodine; magnesium; In tetrahydrofuran; at 60 - 70 ℃; for 4h; Inert atmosphere;

N-benzyl-2-piperidinone; In tetrahydrofuran; at 30 ℃; for 6h; Inert atmosphere;

With water; In tetrahydrofuran; at 60 ℃; for 3h; Temperature; Inert atmosphere;

Reference yield: 80.0%

CH2Cl2Cl2 + 4-(4-chlorophenyl)-4-hydroxypiperidine (39512-49-7) + benzyl bromide (100-39-0) → N-benzyl-4-(4-chlorophenyl)-4-hydroxypiperidin (56108-25-9)

Guidance literature:

With potassium carbonate; In methanol; dichloromethane; N,N-dimethyl-formamide;

upstream raw materials:

bromochlorobenzene

1-phenylmethyl-4-piperidone

4-(4-chlorophenyl)-4-hydroxypiperidine

benzyl bromide

Downstream raw materials:

4-(4-chlorophenyl)-1,2,3,6-tetrahydro-1-(phenylmethyl)-pyridine

4-(4-chlorophenyl)-1,2,3,6-tetrahydropyridine hydrochloride

N-benzyl-4-(4-chlorophenyl)-4-fluoropiperidine:

4-(4-chlorophenyl)piperidine