2-(1-Methyl-piperidin-4-ylmethoxy)-ethanol

Base Information

• Chemical Name: 2-(1-Methyl-piperidin-4-ylmethoxy)-ethanol
• CAS No.: 112391-05-6
• Molecular Formula: C9H19NO2
• Molecular Weight: 173.25300
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID50550883
• Wikidata: Q82430367
• Mol file: 112391-05-6.mol

Synonyms:2-(1-Methyl-piperidin-4-ylmethoxy)-ethanol;112391-05-6;2-[(1-METHYLPIPERIDIN-4-YL)METHOXY]ETHANOL;2-[(1-Methylpiperidin-4-yl)methoxy]ethan-1-ol;DTXSID50550883;AM90671;SB42415

Chemical Property of 2-(1-Methyl-piperidin-4-ylmethoxy)-ethanol

Chemical Property:

• Boiling Point: 260.0±10.0 °C(Predicted)
• PKA: 14.40±0.10(Predicted)
• PSA: 32.70000
• Density: 0.987±0.06 g/cm3(Predicted)
• LogP: 0.27500
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 173.141578849
• Heavy Atom Count: 12
• Complexity: 111

Purity/Quality:

≥95% ^*data from raw suppliers

2-(1-Methyl-piperidin-4-ylmethoxy)-ethanol 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCC(CC1)COCCO

Technology Process of 2-(1-Methyl-piperidin-4-ylmethoxy)-ethanol

There total 3 articles about 2-(1-Methyl-piperidin-4-ylmethoxy)-ethanol 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:

pyridine-4-carbaldehyde (872-85-5) → 4-(4-hydroxy-2-oxabutyl)-1-methylpiperidine (112391-05-6)

Guidance literature:

Multi-step reaction with 3 steps

1: 90 percent / p-toluenesulfonic acid / 4 h / Heating

2: 95 percent / diethyl ether / 10 h / 10 - 15 °C

3: 1. NaBH₄; 2. hydrogen / PtO₂ / 1. water, r.t., 30min.; 2. methanol, 40 psi, 60 degC, 35h

With sodium tetrahydroborate; hydrogen; toluene-4-sulfonic acid; platinum(IV) oxide; In diethyl ether;

Reference yield:

4-[1,3]dioxolan-2-yl-pyridine (61379-59-7) → 4-(4-hydroxy-2-oxabutyl)-1-methylpiperidine (112391-05-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 95 percent / diethyl ether / 10 h / 10 - 15 °C

2: 1. NaBH₄; 2. hydrogen / PtO₂ / 1. water, r.t., 30min.; 2. methanol, 40 psi, 60 degC, 35h

With sodium tetrahydroborate; hydrogen; platinum(IV) oxide; In diethyl ether;

Reference yield:

4-(1,3-dioxolan-2-yl)-1-methylpyridinium iodide (58795-05-4) → 4-(4-hydroxy-2-oxabutyl)-1-methylpiperidine (112391-05-6) + 4-(1,3-dioxolan-2-yl)-1-methylpiperidine (112391-04-5)

Guidance literature:

With sodium tetrahydroborate; hydrogen; platinum(IV) oxide; Yield given. Multistep reaction. Yields of byproduct given; 1. water, r.t., 30min.; 2. methanol, 40 psi, 60 degC, 35h;

upstream raw materials:

4-(1,3-dioxolan-2-yl)-1-methylpyridinium iodide

pyridine-4-carbaldehyde

4-[1,3]dioxolan-2-yl-pyridine