4-(Morpholine-4-carbonyl)piperidin-1-ium

Base Information

• Chemical Name: 4-(Morpholine-4-carbonyl)piperidin-1-ium
• CAS No.: 94467-73-9
• Molecular Formula: C₁₀H₁₈N₂O₂*ClH
• Molecular Weight: 234.726
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID20915506
• Wikidata: Q82886520
• Mol file: 94467-73-9.mol

Synonyms:DTXSID20915506;4-(morpholine-4-carbonyl)piperidin-1-ium

Chemical Property of 4-(Morpholine-4-carbonyl)piperidin-1-ium

Chemical Property:

• Vapor Pressure: 1.16E-05mmHg at 25°C
• Melting Point: 279-286
• Boiling Point: 369.8 °C at 760 mmHg
• Flash Point: 177.4 °C
• PSA: 41.57000
• Density: 1.21g/cm3
• LogP: 0.91350
• XLogP3: -0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 199.144652853
• Heavy Atom Count: 14
• Complexity: 196

Purity/Quality:

98%Min ^*data from raw suppliers

4-(Piperidin-4-ylcarbonyl)morpholine hydrochloride 90% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C[NH2+]CCC1C(=O)N2CCOCC2

Technology Process of 4-(Morpholine-4-carbonyl)piperidin-1-ium

There total 2 articles about 4-(Morpholine-4-carbonyl)piperidin-1-ium 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: 96.0%

morpholin-4-yl(pyridin-4-yl)methanone (52482-36-7) → morpholino(piperidine-4-yl)methanone hydrochloride (94467-73-9)

Guidance literature:

With 1,1,2-trichloroethane; palladium 10% on activated carbon; hydrogen; In methanol; at 20 ℃; for 18h; under 2585.81 Torr;

DOI:10.1016/j.tet.2009.08.011

Reference yield: 69.0%

morpholine (110-91-8,99108-56-2) + piperidine-4-carboxylic acid hydrochloride (5984-56-5) → morpholino(piperidine-4-yl)methanone hydrochloride (94467-73-9)

Guidance literature:

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; In N,N-dimethyl-formamide; at 20 ℃;

upstream raw materials:

morpholin-4-yl(pyridin-4-yl)methanone

morpholine

piperidine-4-carboxylic acid hydrochloride

Refernces

• 1、 Cheng, Chuanjie,Xu, Jimin,Zhu, Rui,Xing, Lixin,Wang, Xinyan,Hu, Yuefei. "A highly efficient Pd-C catalytic hydrogenation of pyridine nucleus under mild conditions". supporting information; experimental part. p. 8538 - 8541. Retrieved 2009/12/24.