4-Chloro-1-methylpiperidine hydrochloride

Base Information

• Chemical Name: 4-Chloro-1-methylpiperidine hydrochloride
• CAS No.: 5382-23-0
• Molecular Formula: C6H12ClN^.HCl
• Molecular Weight: 170.082
• Hs Code.: 29333999
• European Community (EC) Number: 226-375-2
• NSC Number: 76039
• UNII: 5QDX0Y5PMJ
• DSSTox Substance ID: DTXSID20202100
• Mol file: 5382-23-0.mol

Synonyms:5382-23-0;4-Chloro-1-methylpiperidine hydrochloride;1-Methyl-4-chloropiperidine hydrochloride;4-Chloro-N-methylpiperidine hydrochloride;4-Chloro-1-methylpiperidinium chloride;n-methyl-4-chloropiperidine hydrochloride;Piperidine, 4-chloro-1-methyl-, hydrochloride;4-Chloro-1-methylpiperidine, HCl;EINECS 226-375-2;5QDX0Y5PMJ;4-chloro-1-methylpiperidine;hydrochloride;NSC-76039;4-Chloro-1-methylpiperidine-d4Hydrochloride;1-Methyl -4- Chloro Piperidine;UNII-5QDX0Y5PMJ;SCHEMBL490234;DTXSID20202100;QDOJNWFOCOWAPO-UHFFFAOYSA-N;NSC76039;MFCD00012834;NSC 76039;AKOS005259871;SB41080;1-Methyl-4-chloropiperidinehydrochloride;4-CHLORO-1-METHYLPIPERIDINE HCL;AC-15426;AS-11810;4-chloro-1-methyl-piperidine hydrochloride;C1085;FT-0618234;4-Chloro-1-methylpiperidine hydrochloride, 99%;A829780;W-105703;PIPERIDINE, 4-CHLORO-1-METHYL-, HYDROCHLORIDE (1:1

Chemical Property of 4-Chloro-1-methylpiperidine hydrochloride

Chemical Property:

• Appearance/Colour: Off-white powder and chunks.
• Vapor Pressure: 1.85mmHg at 25°C
• Melting Point: 162-164 °C
• Boiling Point: 165.7 °C at 760 mmHg
• Flash Point: 54 °C
• PSA: 3.24000
• Density: 1.04 g/cm³
• LogP: 2.05930
• Storage Temp.: -20?C Freezer
• Sensitive.: Hygroscopic
• Solubility.: DMSO, Methanol, Water
• Water Solubility.: very faint turbidity
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 169.0425048
• Heavy Atom Count: 9
• Complexity: 66.9

Purity/Quality:

99.9% ^*data from raw suppliers

4-Chloro-1-methylpiperidine hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CN1CCC(CC1)Cl.Cl
• Uses: 4-Chloro-1-methylpiperidine Hydrochloride (cas# 5382-23-0) is a compound useful in organic synthesis.

Technology Process of 4-Chloro-1-methylpiperidine hydrochloride

There total 2 articles about 4-Chloro-1-methylpiperidine hydrochloride 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-methoxybenzalacetone (60438-50-8,10542-87-7) → 4-(o-methoxyphenyl)-butan-2-one (63449-79-6) + 4-chloro-N-methyl-piperidine hydrochloride (5382-23-0)

Guidance literature:

Reference yield:

→ 4-chloro-N-methyl-piperidine hydrochloride (5382-23-0)

Guidance literature:

Reference yield: 58.0%

3-aminothiophenol (22948-02-3) + 4-chloro-N-methyl-piperidine hydrochloride (5382-23-0) → 3-(1-methylpiperidin-4-ylsulfanyl)phenylamine (790668-23-4)

Guidance literature:

With caesium carbonate; In DMF (N,N-dimethyl-formamide); at 80 ℃; for 18h;

upstream raw materials:

2-methoxybenzalacetone

Downstream raw materials:

4-chloro-1-methylpiperidine

3-(1-methylpiperidin-4-ylsulfanyl)phenylamine

4-((1-methylpiperidin-4-yl)oxy)benzaldehyde

FR 194921

Refernces