Pheneridine

Base Information

• Chemical Name: Pheneridine
• CAS No.: 469-80-7
• Molecular Formula: C₂₂H₂₇NO₂
• Molecular Weight: 337.462
• UNII: 2UG271VI0Z
• DSSTox Substance ID: DTXSID60196978
• Wikipedia: Pheneridine
• Wikidata: Q7181336
• NCI Thesaurus Code: C66370
• ChEMBL ID: CHEMBL285517
• Mol file: 469-80-7.mol

Synonyms:Pheneridine;Pheneridine [INN];469-80-7;UNII-2UG271VI0Z;2UG271VI0Z;ethyl 4-phenyl-1-(2-phenylethyl)piperidine-4-carboxylate;1-(2-Phenylethyl)-4-phenylpiperidine-4-carboxylic acid ethyl ester;Pheneridin;CHEMBL285517;SCHEMBL1922392;DTXSID60196978;Q7181336;Isonipecotic acid, 1-phenethyl-4-phenyl-, ethyl ester;4-Piperidinecarboxylic acid, 4-phenyl-1-(2-phenylethyl)-, ethyl ester

Chemical Property of Pheneridine

Chemical Property:

• Vapor Pressure: 4.14E-08mmHg at 25°C
• Boiling Point: 444.9°Cat760mmHg
• Flash Point: 135.9°C
• PSA: 29.54000
• Density: 1.079g/cm³
• LogP: 3.76390
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 337.204179104
• Heavy Atom Count: 25
• Complexity: 402

Purity/Quality:

PHENERIDINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1(CCN(CC1)CCC2=CC=CC=C2)C3=CC=CC=C3

Technology Process of Pheneridine

There total 6 articles about Pheneridine 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:

Normeperidine (77-17-8) + phenylacetaldehyde (122-78-1) → 1-phenethyl-4-phenyl-piperidine-4-carboxylic acid ethyl ester (469-80-7)

Guidance literature:

With palladium on activated charcoal; ethanol; acetic acid; Hydrogenation_.unter Zusatz von Natriumacetat;

DOI:10.1021/ja01565a050

Reference yield:

ethyl 4-phenyl-4-piperidinecarboxylate hydrochloride (24465-45-0) + 1-phenyl-2-bromoethane (103-63-9) → 1-phenethyl-4-phenyl-piperidine-4-carboxylic acid ethyl ester (469-80-7)

Guidance literature:

With sodium carbonate; butan-1-ol;

DOI:10.1021/ja01565a050

Reference yield:

4-phenyl-4-cyanopiperidine (40481-13-8) → 1-phenethyl-4-phenyl-piperidine-4-carboxylic acid ethyl ester (469-80-7)

Guidance literature:

Multi-step reaction with 2 steps

1: K₂CO₃ / dimethylformamide

2: H₂SO₄ / Heating

With sulfuric acid; potassium carbonate; In N,N-dimethyl-formamide;

DOI:10.1016/j.bmcl.2006.12.042

upstream raw materials:

Normeperidine

phenylacetaldehyde

1-(β-hydroxy-phenethyl)-4-phenyl-piperidine-4-carboxylic acid ethyl ester; hydrochloride

ethyl 4-phenyl-4-piperidinecarboxylate hydrochloride

Refernces