Dimorpholinomethanone

Base Information

• Chemical Name: Dimorpholinomethanone
• CAS No.: 38952-62-4
• Molecular Formula: C9H16N2O3
• Molecular Weight: 200.238
• DSSTox Substance ID: DTXSID901309389
• Nikkaji Number: J936.121I
• ChEMBL ID: CHEMBL1609136
• Mol file: 38952-62-4.mol

Synonyms:Dimorpholinomethanone;38952-62-4;dimorpholin-4-ylmethanone;Morpholine, 4,4'-carbonylbis;4,4'-Carbonyldimorpholine;4-(morpholine-4-carbonyl)morpholine;Di-morpholin-4-yl-methanone;BAS 01511296;Morpholino ketone;Dimorpholino ketone;MLS000071840;4,4'-Carbonylbis[morpholine];SCHEMBL2899860;CHEMBL1609136;DTXSID901309389;HMS1678D19;HMS2416L22;MFCD00593814;STK091425;AKOS000507012;DS-3194;SMR000010599;C2962;CS-0155195;C74983;EN300-7419013;A873742

Chemical Property of Dimorpholinomethanone

Chemical Property:

• Melting Point: 142.0 to 146.0 °C
• PSA: 42.01000
• LogP: -0.35340
• Storage Temp.: 2-8°C
• Solubility.: soluble in Methanol
• XLogP3: -1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 200.11609238
• Heavy Atom Count: 14
• Complexity: 178

Purity/Quality:

99%, ^*data from raw suppliers

Dimorpholinomethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCCN1C(=O)N2CCOCC2

Technology Process of Dimorpholinomethanone

There total 5 articles about Dimorpholinomethanone 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: 67.0%

morpholine (110-91-8,99108-56-2) + carbonic acid dimethyl ester (616-38-6) → 4-methyl-morpholine (109-02-4) + 4,4’-carbonyl-dimorpholine (38952-62-4)

Guidance literature:

at 110 ℃; for 10h; atmospheric pressure;

DOI:10.1080/00397910500278578

Reference yield:

4-morpholinocarbonyl chloride (15159-40-7) + n-butyllithium (109-72-8,29786-93-4) → 4-morpholinecarboxaldehyde (4394-85-8) + 1-morpholinopentan-1-one (22342-18-3) + 4,4’-carbonyl-dimorpholine (38952-62-4)

Guidance literature:

n-butyllithium; With CuCN; In diethyl ether; at -30 ℃; for 0.5h;

4-morpholinocarbonyl chloride; In tetrahydrofuran; at -30 - 0 ℃; for 2h;

DOI:10.1021/ol0487130

Reference yield:

4-morpholinocarbonyl chloride (15159-40-7) + sec.-butyllithium (598-30-1) → 4-morpholinecarboxaldehyde (4394-85-8) + 4,4’-carbonyl-dimorpholine (38952-62-4) + 1,2-dimorpholinoethane-1,2-dione (6342-79-6) + 2-methyl-1-morpholin-4-ylbutan-1-one (212190-87-9)

Guidance literature:

sec.-butyllithium; With CuCN; In tetrahydrofuran; at -30 ℃; for 0.5h;

4-morpholinocarbonyl chloride; In tetrahydrofuran; at -30 - 20 ℃; for 2h;

DOI:10.1021/ol0487130

upstream raw materials:

4-morpholinocarbonyl chloride

n-butyllithium

methyllithium

sec.-butyllithium

Downstream raw materials:

5-(4-methoxyphenyl)-2-morpholinooxazol-4(5H)-one

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