4-(4-Methylphenoxy)piperidine hydrochloride

Base Information

• Chemical Name: 4-(4-Methylphenoxy)piperidine hydrochloride
• CAS No.: 63843-49-2
• Molecular Formula: C12H18ClNO
• Molecular Weight: 191.273
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID10589992
• Mol file: 63843-49-2.mol

Synonyms:4-(4-Methylphenoxy)piperidine hydrochloride;65367-97-7;4-(p-tolyloxy)piperidine hydrochloride;4-p-Tolyloxy-piperidine hydrochloride;4-(4-METHYLPHENOXY)PIPERIDINE HCL;4-(4-methylphenoxy)piperidine;hydrochloride;4-(P-tolyloxy)piperidinehydrochloride;4-(4-Methylphenoxy)piperidine, HCl;DTXSID10589992;FUYMHJIAYHLIEH-UHFFFAOYSA-N;Piperidine,4-(4-methylphenoxy)-;AMY11519;AR1778;MFCD02258936;AKOS015844069;SB38143;CS-0172153;4-(4-Methylphenoxy)piperidine hydrochloride, AldrichCPR;4-(4-Methylphenoxy)piperidine--hydrogen chloride (1/1)

Chemical Property of 4-(4-Methylphenoxy)piperidine hydrochloride

Chemical Property:

• Vapor Pressure: 0.00117mmHg at 25°C
• Refractive Index: 1.523
• Boiling Point: 333.4 °C at 760 mmHg
• PKA: 9.76±0.10(Predicted)
• Flash Point: 155.4 °C
• PSA: 21.26000
• Density: 1.016g/cm³
• LogP: 3.25660
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 227.1076919
• Heavy Atom Count: 15
• Complexity: 158

Purity/Quality:

98%Min ^*data from raw suppliers

4-(4-Methylphenoxy)piperidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)OC2CCNCC2.Cl

Technology Process of 4-(4-Methylphenoxy)piperidine hydrochloride

There total 7 articles about 4-(4-Methylphenoxy)piperidine hydrochloride 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: 81.0%

4-HYDROXYPIPERIDINE (5382-16-1) + 4-tolyl iodide (624-31-7) → 4-(p-tolyloxy)-piperidine (63843-49-2)

Guidance literature:

With 3,4,7,8-Tetramethyl-o-phenanthrolin; 3 A molecular sieve; caesium carbonate; copper(l) iodide; at 110 ℃; for 20h;

DOI:10.1021/ja068926f

Reference yield:

1-benzyl-4-p-tolyloxy-1,2,3,6-tetrahydro-pyridine → 4-(p-tolyloxy)-piperidine (63843-49-2)

Guidance literature:

With hydrogen; palladium on activated charcoal; In methanol; at 20 ℃;

DOI:10.1016/j.bmcl.2004.05.053

Reference yield:

4-Chloropyridine (626-61-9) → 4-(p-tolyloxy)-piperidine (63843-49-2)

Guidance literature:

Multi-step reaction with 4 steps

1: 1-(4-pyridyl)pyridinium chloride hydrochloride / 6 h / 220 °C

2: diethyl ether / 48 h / 20 °C

3: NaBH₄ / ethanol

4: H₂ / Pd/C / methanol / 20 °C

With sodium tetrahydroborate; hydrogen; 1-(4-pyridyl)pyridinium chloride hydrochloride; palladium on activated charcoal; In methanol; diethyl ether; ethanol;

DOI:10.1016/j.bmcl.2004.05.053

upstream raw materials:

4-HYDROXYPIPERIDINE

4-tolyl iodide

4-Chloropyridine

p-cresol

Downstream raw materials:

1-[4-(tetrahydro-pyran-2-yloxy)-phenyl]-4-p-tolyloxy-piperidine

oxo-(4-p-tolyloxy-piperidin-1-yl)-acetic acid

(6-bromopyridin-3-yl)[4-(p-tolyloxy)piperidin-1-yl]methanone

Refernces

• 1、 Barta-Szalai, Gizella,Borza, Istvan,Bozo, Eva,Kiss, Csilla,Agai, Bela,Proszenyak, Agnes,Keseru, Gyoergy M.,Gere, Aniko,Kolok, Sandor,Galgoczy, Kornel,Horvath, Csilla,Farkas, Sandor,Domany, Gyoergy. "Oxamides as novel NR2B selective NMDA receptor antagonists". . p. 3953 - 3956. Retrieved 2007/10/03.
• 2、 -. "Method of treating pain and hypertension". . . Retrieved 2008/06/13.