4'-Morpholinoacetophenone

Base Information

• Chemical Name: 4'-Morpholinoacetophenone
• CAS No.: 39910-98-0
• Molecular Formula: C12H15NO2
• Molecular Weight: 205.257
• Hs Code.: 29349990
• European Community (EC) Number: 254-698-9
• UNII: VJ32JDU2T4
• DSSTox Substance ID: DTXSID30192967
• Nikkaji Number: J33.807I
• Wikidata: Q83065651
• Mol file: 39910-98-0.mol

Synonyms:39910-98-0;4'-Morpholinoacetophenone;4-Morpholinoacetophenone;1-(4-Morpholinophenyl)ethanone;Ethanone, 1-[4-(4-morpholinyl)phenyl]-;ACETOPHENONE, 4'-MORPHOLINO-;1-(4-morpholin-4-ylphenyl)ethanone;p-Morpholinoacetophenone;MFCD00006168;1-(4-Morpholin-4-yl-phenyl)-ethanone;BRN 1214737;1-[4-(morpholin-4-yl)phenyl]ethan-1-one;EINECS 254-698-9;VJ32JDU2T4;Ethanone, 1-(4-(4-morpholinyl)phenyl)-;p-Morpholino acetophenone;4`-Morpholinoacetophenone;para-Morpholinoacetophenone;4'-morpholino acetophenone;4''-Morpholinoacetophenone;UNII-VJ32JDU2T4;n-(4-acetylphenyl)morpholine;4 inverted exclamation mark -Morpholinoacetophenone;SCHEMBL334850;1-(4-morpholinophenyl) ethanone;4'-Morpholinoacetophenone, 99%;AKQWEDMTPCAESO-UHFFFAOYSA-;DTXSID30192967;1-(4-morpholinophenyl)ethan-1-one;STL387745;1-[4-(4-Morpholinyl)phenyl]ethanone;AKOS000221608;AC-3230;CCG-291711;1-[4-(4-morpholinyl)phenyl] Ethanone;1-[4-(morpholin-4-yl)phenyl]ethanone;1-[4-(4-morpholinyl) phenyl] ethanone;1-[4-(4-Morpholinyl)phenyl]ethanone #;SY004868;CS-0204367;FT-0619151;EN300-17200;2W-0823;A824803;SR-01000533584;SR-01000533584-1;Z56899083;1-(4-morpholinophenyl)ethanone;F0001-1123

Chemical Property of 4'-Morpholinoacetophenone

Chemical Property:

• Vapor Pressure: 7.13E-06mmHg at 25°C
• Melting Point: 96-98oC(lit.)
• Refractive Index: 1.5160 (estimate)
• Boiling Point: 376.7°Cat760mmHg
• PKA: 2.23±0.40(Predicted)
• Flash Point: 181.6°C
• PSA: 29.54000
• Density: 1.113g/cm³
• LogP: 1.79080
• Storage Temp.: Sealed in dry,Room Temperature
• 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: 216

Purity/Quality:

98%, ^*data from raw suppliers

1-(4-Morpholinophenyl)ethanone ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

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

Technology Process of 4'-Morpholinoacetophenone

There total 19 articles about 4'-Morpholinoacetophenone 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: 100.0%

morpholine (110-91-8,99108-56-2) + para-bromoacetophenone (99-90-1) → 4-morpholinoacetophenone (39910-98-0)

Guidance literature:

With 2-(dicyclohexylphosphino)-4'-(N,N-dimethylamino)-1,1'-biphenyl; at 100 ℃;

DOI:10.1021/ja902679b

Reference yield: 99.0%

morpholine (110-91-8,99108-56-2) + para-chloroacetophenone (99-91-2) → 4-morpholinoacetophenone (39910-98-0)

Guidance literature:

With potassium tert-butylate; In 1,2-dimethoxyethane; at 50 ℃; for 20h; Inert atmosphere;

DOI:10.1055/s-2008-1067274

Reference yield: 93.0%

morpholine (110-91-8,99108-56-2) + 1-(4-fluorophenyl)ethanone (403-42-9) → 4-morpholinoacetophenone (39910-98-0)

Guidance literature:

In water;

upstream raw materials:

morpholine

para-bromoacetophenone

1-(4-fluorophenyl)ethanone

para-chloroacetophenone

Downstream raw materials:

2-(4-chloro-phenyl)-6-(4-morpholin-4-yl-phenyl)-pyran-4-one

2-(2-chloro-phenyl)-6-(4-morpholin-4-yl-phenyl)-pyran-4-one

2-(4-morpholin-4-yl-phenyl)-6-p-tolyl-pyran-4-one

N-[2-(4-morpholin-4-yl-benzoyl)-1,3-dioxo-indan-4-yl]-acetamide

Refernces

• 1、 Metallinos, Costa,Zaifman, Josh,Dodge, Laura. "Aminoferrocene lithiation by boron trifluoride activation". . p. 3527 - 3530. Retrieved 2008.
• 2、 Dey, Arnab,Volla, Chandra M. R.. "Cobalt-Catalyzed C-H Activation and [3 + 2] Annulation with Allenes: Diastereoselective Synthesis of Indane Derivatives". supporting information. p. 5018 - 5023. Retrieved 2021/07/19.
• 3、 Barbosa, Sandro L.,Baroni, Adriano C. M.,Croda, Júlio,Gomes, Giovana B.,Guerrero, Palimécio G.,Moreira, Flora M. F.,Oliveira, Jefferson R. S.,Perdomo, Renata T.,Shiguemoto, Cristiane Y. K.,das Neves, Amarith R.. "Design, Synthesis and Antitubercular Activity of Novel Isoniazid?Cyclic?Amine?Azachalcones Hybrids". . p. 1284 - 1295. Retrieved 2020/10/14.