(4-Methylphenyl)morpholin-4-ylmethanone

Base Information

• Chemical Name: (4-Methylphenyl)morpholin-4-ylmethanone
• CAS No.: 63833-44-3
• Molecular Formula: C12H15NO2
• Molecular Weight: 205.257
• Hs Code.: 2934999090
• NSC Number: 38132
• DSSTox Substance ID: DTXSID80284644
• Nikkaji Number: J1.795.668J
• Wikidata: Q72495063
• Mol file: 63833-44-3.mol

Synonyms:63833-44-3;(4-METHYLPHENYL)MORPHOLIN-4-YLMETHANONE;morpholino(p-tolyl)methanone;(4-methylphenyl)-morpholin-4-ylmethanone;4-(4-methylbenzoyl)morpholine;p-Toluic acid, morpholide;(4-methylphenyl)(morpholin-4-yl)methanone;p-Toluylic acid, morpholide;Enamine_000047;SCHEMBL12871;DTXSID80284644;AUJPGGARDMBNMW-UHFFFAOYSA-N;HMS1394C03;NSC38132;2-Chlorobenzyl4-methoxylphenylketone;NSC-38132;STK414044;AKOS000727817;(4-methylphenyl)-(4-morpholinyl)methanone;(4-METHYLPHENYL)(MORPHOLINO)METHANONE;CS-0281243;A834545;SR-01000317283;SR-01000317283-1;BRD-K67722612-001-01-2;Z31721341

Chemical Property of (4-Methylphenyl)morpholin-4-ylmethanone

Chemical Property:

• Vapor Pressure: 1.42E-05mmHg at 25°C
• Melting Point: 73-74 °C
• Refractive Index: 1.551
• Boiling Point: 366.8 °C at 760 mmHg
• Flash Point: 175.7 °C
• PSA: 29.54000
• Density: 1.128 g/cm³
• LogP: 1.40530
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 205.110278721
• Heavy Atom Count: 15
• Complexity: 216

Purity/Quality:

99% ^*data from raw suppliers

(4-METHYLPHENYL)MORPHOLIN-4-YL METHANONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C(=O)N2CCOCC2

Technology Process of (4-Methylphenyl)morpholin-4-ylmethanone

There total 56 articles about (4-Methylphenyl)morpholin-4-ylmethanone 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: 99.0%

morpholine (110-91-8,99108-56-2) + 4-methyl-benzaldehyde (104-87-0) → morpholino(p-tolyl)methanone (63833-44-3)

Guidance literature:

With oxygen; sodium hydroxide; In tetrahydrofuran; water; at 10 ℃; for 23h;

DOI:10.1002/anie.201501795

Reference yield: 99.0%

morpholine (110-91-8,99108-56-2) + carbon monoxide (201230-82-2) + 4-tolyl iodide (624-31-7) → morpholino(p-tolyl)methanone (63833-44-3)

Guidance literature:

With dipotassium hydrogenphosphate; palladium; potassium iodide; In 1,4-dioxane; at 130 ℃; for 12h; under 3750.38 Torr; Autoclave; Green chemistry;

DOI:10.1039/c8gc00740c

Reference yield: 97.0%

morpholine (110-91-8,99108-56-2) + 4-Methylbenzyl alcohol (589-18-4) → morpholino(p-tolyl)methanone (63833-44-3)

Guidance literature:

With 1.9 mol% Au/HT; potassium tert-butylate; In o-xylene; at 90 ℃; for 36h; Inert atmosphere;

DOI:10.1016/j.tetlet.2012.04.048

upstream raw materials:

9,10-Dicyanoanthracene

2-morpholinyl-2-phenyl-1-(4-methylphenyl)-1-ethanone

morpholine

2,4-dinitrophenyl 4-methylbenzoate

Downstream raw materials:

2-(4-methylbenzoyl)pyrrole

2,4-dimethyl-5-(4-methyl-benzoyl)-pyrrole-3-carboxylic acid ethyl ester

1,9-bis(4-methylbenzoyl)-5-(mesityl)dipyrromethane

(1-Allyl-1H-pyrrole-2-yl) (4-methylphenyl)methanone

Refernces

• 1、 Boyle, Mhairi,Livingstone, Keith,Henry, Martyn C.,Elwood, Jessica M. L.,Lopez-Fernandez, J. Daniel,Jamieson, Craig. "Amide Bond Formation via the Rearrangement of Nitrile Imines Derived from N-2-Nitrophenyl Hydrazonyl Bromides". supporting information. p. 334 - 338. Retrieved 2022/01/20.
• 2、 Xu, Ling,Zhang, Shuai-Zheng,Li, Wei,Zhang, Zhan-Hui. "Visible-Light-Mediated Oxidative Amidation of Aldehydes by Using Magnetic CdS Quantum Dots as a Photocatalyst". . p. 5483 - 5491. Retrieved 2021/03/01.