4-(Methoxymethyl)piperidine

Base Information

• Chemical Name: 4-(Methoxymethyl)piperidine
• CAS No.: 399580-55-3
• Molecular Formula: C7H15NO
• Molecular Weight: 129.202
• Hs Code.: 2933399090
• European Community (EC) Number: 815-030-7
• DSSTox Substance ID: DTXSID20405851
• Wikidata: Q72490637
• Mol file: 399580-55-3.mol

Synonyms:4-(methoxymethyl)piperidine;399580-55-3;4-Methoxymethyl-piperidine;Piperidine, 4-(methoxymethyl)-;4-Methoxymethylpiperidine;SCHEMBL82090;4-(methoxy methyl)piperidine;F2145-0240;4-(4-methoxy methyl)piperidine;SCHEMBL13088412;DTXSID20405851;IHJDIDHHEBJPDL-UHFFFAOYSA-N;MFCD06248041;STK893137;AKOS000194643;BS-3769;PB18718;4-(Methoxymethyl)piperidine, AldrichCPR;AM100768;A6671;BB 0253673;CS-0051142;FT-0694854;EN300-75762;P10350

Chemical Property of 4-(Methoxymethyl)piperidine

Chemical Property:

• Vapor Pressure: 1.67mmHg at 25°C
• Melting Point: 0 °C
• Refractive Index: 1.425
• Boiling Point: 167.8 °C at 760 mmHg
• PKA: 10.41±0.10(Predicted)
• Flash Point: 60.1 °C
• PSA: 21.26000
• Density: 0.882 g/cm³
• LogP: 0.96120
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 129.115364102
• Heavy Atom Count: 9
• Complexity: 69.3

Purity/Quality:

98%,99%, ^*data from raw suppliers

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COCC1CCNCC1

Technology Process of 4-(Methoxymethyl)piperidine

There total 4 articles about 4-(Methoxymethyl)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:

1-tert-Butyloxycarbonyl-4-methoxymethyl-piperidine (509147-78-8) → 4-(methoxymethyl)piperidine (399580-55-3)

Guidance literature:

1-tert-Butyloxycarbonyl-4-methoxymethyl-piperidine; With trifluoroacetic acid; In dichloromethane;

With sodium hydroxide; In dichloromethane; water;

Reference yield:

4-methoxymethyl-piperidin-2-one (858263-30-6) → 4-(methoxymethyl)piperidine (399580-55-3)

Guidance literature:

With sodium; butan-1-ol;

DOI:10.1021/ja01252a068

Reference yield:

4-methoxymethyl-2-oxo-piperidine-3-carboxylic acid ethyl ester (99190-03-1) → 4-(methoxymethyl)piperidine (399580-55-3)

Guidance literature:

Multi-step reaction with 2 steps

1: aqueous KOH-solution / anschliessend mit wss.Schwefelsaeure und Erwaermen des Reaktionsprodukts auf 100grad

2: butan-1-ol; sodium

With potassium hydroxide; sodium; butan-1-ol;

DOI:10.1021/ja01252a068

upstream raw materials:

4-methoxymethyl-piperidin-2-one

4-methoxymethyl-2-oxo-piperidine-3-carboxylic acid ethyl ester

1-tert-Butyloxycarbonyl-4-methoxymethyl-piperidine

Downstream raw materials:

N-(4-(3-(4-(methoxymethyl)piperidin-1-yl)pyrazin-2-yloxy)phenyl)benzo[d]thiazol-2-amine

C₃₆H₄₉N₅O₇

4-(2-hydroxypropan-2-yl)-N-(7-(4-(methoxymethyl)piperidin-1-yl)pyrazolo[1,5-a]pyrimidin-5-yl)benzamide

4-methoxymethyl-piperidinoamine

Refernces

• 1、 -. "Benzimidazolidinone derivatives as muscarinic agents". Page/Page column 36. . Retrieved 2010/02/06.