1-(3-Morpholin-4-ylphenyl)ethanone

Base Information

• Chemical Name: 1-(3-Morpholin-4-ylphenyl)ethanone
• CAS No.: 59695-23-7
• Molecular Formula: C12H15NO2
• Molecular Weight: 205.257
• Hs Code.: 2934999090
• European Community (EC) Number: 802-030-7
• DSSTox Substance ID: DTXSID90428097
• Nikkaji Number: J2.062.571F
• Wikidata: Q82240882
• ChEMBL ID: CHEMBL4584958
• Mol file: 59695-23-7.mol

Synonyms:59695-23-7;1-(3-morpholin-4-ylphenyl)ethanone;m-Morpholinoacetophenone;1-(3-Morpholinophenyl)ethanone;1-(3-MORPHOLIN-4-YL-PHENYL)-ETHANONE;1-(3-morpholinophenyl)ethan-1-one;1-[3-(Morpholin-4-yl)phenyl]ethan-1-one;Ethanone, 1-[3-(4-morpholinyl)phenyl]-;3'-(4-Morpholinyl)acetophenone;CHEMBL4584958;SCHEMBL13724478;DTXSID90428097;MFCD06740093;AKOS001260878;AS-38138;CS-0171641;EN300-24717;A917802;Z199512500

Chemical Property of 1-(3-Morpholin-4-ylphenyl)ethanone

Chemical Property:

• PSA: 29.54000
• LogP: 1.79080
• Storage Temp.: 2-8°C
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 205.110278721
• Heavy Atom Count: 15
• Complexity: 224

Purity/Quality:

97% ^*data from raw suppliers

1-(3-Morpholin-4-ylphenyl)ethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC(=CC=C1)N2CCOCC2

Technology Process of 1-(3-Morpholin-4-ylphenyl)ethanone

There total 5 articles about 1-(3-Morpholin-4-ylphenyl)ethanone 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: 77.0%

morpholine (110-91-8,99108-56-2) + 3-acetylphenyl p-toluenesulfonate (58297-34-0) → 1-(3-morpholinophenyl)ethan-1-one (59695-23-7)

Guidance literature:

With potassium phosphate; C₃₆H₅₀Cl₃N₅Pd; In tert-Amyl alcohol; at 120 ℃; for 18h; chemoselective reaction; Inert atmosphere; Schlenk technique;

DOI:10.1021/acs.joc.5b01272

Reference yield: 40.0%

morpholine (110-91-8,99108-56-2) + 1-(3-Bromophenyl)ethanone (2142-63-4) → 1-(3-morpholinophenyl)ethan-1-one (59695-23-7)

Guidance literature:

With copper(l) iodide; potassium carbonate; L-proline; In dimethyl sulfoxide; at 90 ℃; for 24h;

DOI:10.1002/anie.201903019

Reference yield:

morpholine (110-91-8,99108-56-2) + para-bromoacetophenone (99-90-1) → 1-(3-morpholinophenyl)ethan-1-one (59695-23-7) + 4-morpholinoacetophenone (39910-98-0)

Guidance literature:

With sodium amide;

DOI:10.1007/BF01106674

upstream raw materials:

morpholine

para-bromoacetophenone

N-methoxy-N-methyl-3-morpholin-4-yl-benzamide

methylmagnesium bromide