2-(2-Chloroethyl)-1-methylpiperidine

Base Information

• Chemical Name: 2-(2-Chloroethyl)-1-methylpiperidine
• CAS No.: 50846-01-0
• Molecular Formula: C8H16ClN
• Molecular Weight: 161.675
• Hs Code.: 2933399090
• European Community (EC) Number: 256-796-7
• DSSTox Substance ID: DTXSID60965080
• Nikkaji Number: J304.089E
• Mol file: 50846-01-0.mol

Synonyms:2-(2-Chloroethyl)-1-methylpiperidine;50846-01-0;EINECS 256-796-7;Piperidine, 2-(2-chloroethyl)-1-methyl-;1-methyl-2-(2-chloroethyl)-piperidine;SCHEMBL4283752;DTXSID60965080;UMYMWCKSANKFPI-UHFFFAOYSA-N;STK503891;AKOS005171596;2-(2-chloroethyl)-N-methyl piperidine;2-(2-chloroethyl)-N-methyl-piperidine;BB 0256692;(/-)2-(2-Chloroethyl)-1-methyl piperidine

Chemical Property of 2-(2-Chloroethyl)-1-methylpiperidine

Chemical Property:

• Vapor Pressure: 0.255mmHg at 25°C
• Melting Point: 111-113 °C
• Boiling Point: 205.1°Cat760mmHg
• PKA: 9.74±0.10(Predicted)
• Flash Point: 77.8°C
• PSA: 3.24000
• Density: 0.971g/cm³
• LogP: 2.03750
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 161.0971272
• Heavy Atom Count: 10
• Complexity: 95.3

Purity/Quality:

99.9% ^*data from raw suppliers

2-(2-CHLOROETHYL)-1-METHYLPIPERIDINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCCCC1CCCl

Technology Process of 2-(2-Chloroethyl)-1-methylpiperidine

There total 5 articles about 2-(2-Chloroethyl)-1-methylpiperidine 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:

2-(1-methyl-piperidin-2-yl)-ethanol (533-15-3) → 2-(2-chloroethyl)-1-methylpiperidine (50846-01-0)

Guidance literature:

With hydrogenchloride; chloroform; Anschliessendes Erwaermen mit Thionylchlorid_.;

DOI:10.1021/ja01128a014 DOI:10.1021/ja01212a058

Reference yield:

2-(2-Hydroxyethyl)pyridine (103-74-2) → 2-(2-chloroethyl)-1-methylpiperidine (50846-01-0)

Guidance literature:

Multi-step reaction with 2 steps

1: acetonitrile / und Hydrieren des Reaktionsprodukts in Methanol an Platin

2: chloroform; hydrogen chloride / Anschliessendes Erwaermen mit Thionylchlorid_.

With hydrogenchloride; chloroform; acetonitrile;

DOI:10.1021/ja01212a058

Reference yield:

→ 2-(2-chloroethyl)-1-methylpiperidine (50846-01-0)

Guidance literature:

upstream raw materials:

2-(1-methyl-piperidin-2-yl)-ethanol

2-(2-Hydroxyethyl)pyridine

Downstream raw materials:

thioridazine

(3-chloro-phenyl)-[2-(1-methyl-[2]piperidyl)-ethyl]-phenyl-amine

[2-(1-methyl-[2]piperidyl)-ethyl]-phenyl-m-tolyl-amine

2-chloro-7-methoxy-10-[2-(1-methyl-piperidin-2-yl)-ethyl]-10H-phenothiazine

Refernces