4-(4-Chloro-phenoxymethyl)-piperidine

Base Information

• Chemical Name: 4-(4-Chloro-phenoxymethyl)-piperidine
• CAS No.: 63608-33-3
• Molecular Formula: C12H16 Cl N O
• Molecular Weight: 225.71500
• DSSTox Substance ID: DTXSID40424665
• Wikidata: Q82237336
• Mol file: 63608-33-3.mol

Synonyms:4-(4-Chloro-phenoxymethyl)-piperidine;63608-33-3;4-[(4-chlorophenoxy)methyl]piperidine;4-((4-Chlorophenoxy)methyl)piperidine;4-(4-chlorophenoxymethyl)piperidine;SCHEMBL3251238;DTXSID40424665;AKOS000744022;BB 0216465;CS-0331518;A1-03174

Chemical Property of 4-(4-Chloro-phenoxymethyl)-piperidine

Chemical Property:

• Vapor Pressure: 0.000183mmHg at 25°C
• Boiling Point: 328.9oC at 760 mmHg
• Flash Point: 152.7oC
• PSA: 21.26000
• Density: 1.106g/cm3
• LogP: 3.04720
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 225.0920418
• Heavy Atom Count: 15
• Complexity: 175

Purity/Quality:

98%min ^*data from raw suppliers

4-[(4-Chlorophenoxy)methyl]piperidine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNCCC1COC2=CC=C(C=C2)Cl
• Uses: 4-[(4-Chlorophenoxy)methyl]piperidine, is a derivative of Phenoxymethylpiperidines, used for the preparation of pharmaceutical compounds having therapeutic properties.

Technology Process of 4-(4-Chloro-phenoxymethyl)-piperidine

There total 1 articles about 4-(4-Chloro-phenoxymethyl)-piperidine 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:

→ 4-[(4-chlorophenoxy)methyl]piperidine (63608-33-3)

Guidance literature:

d. entspr. N-Benzoyl-Deriv., NaOH, EtOH;

Reference yield:

4-[(4-chlorophenoxy)methyl]piperidine (63608-33-3) + bis(trichloromethyl) carbonate (32315-10-9) + rac-(4aR,8aS)-hexahydro-2H-pyrido[4,3-b][1,4]oxazin-3(4H)-one dihydrochloride salt → rac-(4aR,8aS)-6-(4-((4-chlorophenoxy)methyl)piperidine-1-carbonyl)hexahydro-2H-pyrido[4,3-b][1,4]oxazin-3 (4H)-one

Guidance literature:

4-[(4-chlorophenoxy)methyl]piperidine; bis(trichloromethyl) carbonate; With sodium hydrogencarbonate; In dichloromethane; at 20 ℃;

rac-(4aR,8aS)-hexahydro-2H-pyrido[4,3-b][1,4]oxazin-3(4H)-one dihydrochloride salt; With N-ethyl-N,N-diisopropylamine; In dichloromethane; at 20 ℃; for 19h;