4-(3-Methoxyphenyl)piperidine

Base Information

• Chemical Name: 4-(3-Methoxyphenyl)piperidine
• CAS No.: 99329-55-2
• Molecular Formula: C12H17NO
• Molecular Weight: 191.273
• European Community (EC) Number: 844-568-5
• DSSTox Substance ID: DTXSID40443699
• Wikidata: Q82261610
• ChEMBL ID: CHEMBL2021615
• Mol file: 99329-55-2.mol

Synonyms:4-(3-methoxyphenyl)piperidine;99329-55-2;4-(3-methoxyphenyl)-piperidine;CHEMBL2011550;Piperidine, 4-(3-methoxyphenyl)-;SCHEMBL1092061;CHEMBL2021615;DTXSID40443699;4-(3-Methoxy-phenyl)-piperidine;NONQCMNVMIGQEE-UHFFFAOYSA-N;BDBM50379807;MFCD05189908;STK500913;AKOS000209242;SB41680;AS-47414;FT-0760006;EN300-145494;F13632;F8880-7505;Z320116690

Chemical Property of 4-(3-Methoxyphenyl)piperidine

Chemical Property:

• PSA: 21.26000
• LogP: 2.49100
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 191.131014166
• Heavy Atom Count: 14
• Complexity: 166

Purity/Quality:

99%, ^*data from raw suppliers

4-(3-methoxyphenyl)piperidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=CC(=C1)C2CCNCC2

Technology Process of 4-(3-Methoxyphenyl)piperidine

There total 4 articles about 4-(3-Methoxyphenyl)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: 6.0%

→ 1,2,3,6-Tetrahydro-4-methyl-2-oxo-6-[3-[[[[3-[4-(3-methoxyphenyl)-1-piperidinyl]propyl]amino]carbonyl]amino]phenyl]-1, 5-pyrimidinedicarboxylic acid, dimethyl ester (210836-73-0) + 4-(3-methoxyphenyl)piperidine (99329-55-2)

Guidance literature:

Reference yield:

4-(3-methoxy-phenyl)-piperidine-1-carboxylic acid tert-butyl ester (1276045-26-1) → 4-(3-methoxyphenyl)piperidine (99329-55-2)

Guidance literature:

DOI:10.1016/j.bmcl.2007.12.029

Reference yield:

4-(3-methoxy-phenyl)-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester (194669-45-9) → 4-(3-methoxyphenyl)piperidine (99329-55-2)

Guidance literature:

Multi-step reaction with 2 steps

1: 3% Pd/C; hydrogen / ethanol / 760.05 Torr

2: hydrogenchloride / 1,4-dioxane / 20 °C

With hydrogenchloride; 3% Pd/C; hydrogen; In 1,4-dioxane; ethanol;

upstream raw materials:

4-(3-methoxy-phenyl)-piperidine-1-carboxylic acid tert-butyl ester

4-(3-methoxy-phenyl)-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester

Downstream raw materials:

2-(2-{2-[4-(3-Methoxy-phenyl)-piperidin-1-yl]-ethoxy}-phenyl)-thiazolidine-3-carboxylic acid methylamide

2-(2-{2-[4-(3-Methoxy-phenyl)-piperidin-1-yl]-ethoxy}-phenyl)-thiazolidine-3-carbothioic acid methylamide

[4-(3-methoxy-phenyl)-piperidin-1-yl]-acetic acid methyl ester

4(3-Methoxyphenyl)piperidine-1-propanenitrile

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