1-Ethylpiperidin-3-one hydrochloride

Base Information

• Chemical Name: 1-Ethylpiperidin-3-one hydrochloride
• CAS No.: 41361-28-8
• Molecular Formula: C7H14ClNO
• Molecular Weight: 163.647
• Hs Code.: 2933399090
• European Community (EC) Number: 255-333-6
• DSSTox Substance ID: DTXSID60961643
• NSC Number: 329700
• Mol file: 41361-28-8.mol

Synonyms:41361-28-8;1-Ethylpiperidin-3-one hydrochloride;1-Ethyl-3-piperidone hydrochloride;1-Ethyl-3-piperidone HCl;1-ethylpiperidin-3-one;hydrochloride;1-ethyl-3-piperidinone hydrochloride;SCHEMBL2928953;DTXSID60961643;1-Ethylpiperidin-3-onehydrochloride;MFCD00012793;NSC329700;AKOS015912501;NSC-329700;SB41684;BS-42405;1-Ethyl-3-piperidone hydrochloride, 97%;CS-0309133;NS00057232;EN300-1600326;1-Ethylpiperidin-3-one--hydrogen chloride (1/1)

Chemical Property of 1-Ethylpiperidin-3-one hydrochloride

Chemical Property:

• Vapor Pressure: 0.651mmHg at 25°C
• Melting Point: 178-180 °C(lit.)
• Boiling Point: 228.9 °C at 760 mmHg
• Flash Point: 92.2 °C
• PSA: 20.31000
• LogP: 1.41110
• Storage Temp.: Hygroscopic, -20°C Freezer, Under inert atmosphere
• Solubility.: DMSO (Slightly), Methanol (Sparingly), Water (Slightly)
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 163.0763918
• Heavy Atom Count: 10
• Complexity: 112

Purity/Quality:

98%min ^*data from raw suppliers

1-Ethyl-3-piperidinoneHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 37/39-26-36/37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1CCCC(=O)C1.Cl
• Uses: 1-Ethyl-3-piperidinone Hydrochloride used in preparation of Aminoimidazoles. 1-Ethyl-3-piperidone hydrochloride may be used in chemical synthesis studies.

Technology Process of 1-Ethylpiperidin-3-one hydrochloride

There total 1 articles about 1-Ethylpiperidin-3-one 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:

→ 1-ethyl-3-piperidone hydrochloride (41361-28-8)

Guidance literature:

Reference yield: 88.0%

4-(3-chloro-phenylethynyl)-piperidin-4-ol (907994-64-3) + 1-ethyl-3-piperidone hydrochloride (41361-28-8) → 4-(3-chloro-phenylethynyl)-1'-ethyl-[1,3']bipiperidinyl-4-ol

Guidance literature:

4-(3-chloro-phenylethynyl)-piperidin-4-ol; 1-ethyl-3-piperidone hydrochloride; With sodium tris(acetoxy)borohydride; acetic acid; In 1,2-dichloro-ethane; at 25 ℃; for 18h;

With hydrogenchloride; water; In dichloromethane; 1,2-dichloro-ethane;

In water; pH=10; Alkaline aqueous solution;

Reference yield: 80.0%

1-ethyl-3-piperidone hydrochloride (41361-28-8) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → 3,3-diphenyl-N-ethylpiperidine

Guidance literature:

With trifluorormethanesulfonic acid; at 20 ℃; for 3h;

DOI:10.1021/jo990454i

Downstream raw materials:

1-ethyl-3-piperidinone

Refernces