4-(o-Methoxythiobenzoyl)morpholine

Base Information

• Chemical Name: 4-(o-Methoxythiobenzoyl)morpholine
• CAS No.: 57954-41-3
• Molecular Formula: C12H15NO2S
• Molecular Weight: 237.323
• NSC Number: 158107
• DSSTox Substance ID: DTXSID60303387
• Nikkaji Number: J322.634D
• Wikidata: Q82048638

Synonyms:4-(o-Methoxythiobenzoyl)morpholine;57954-41-3;NIOSH/QE5730000;N-Morpholinylthio-o-methoxybenzamide;Morpholine, 4-(o-methoxythiobenzoyl)-;QE57300000;NSC158107;CBMicro_003622;4-(2-METHOXYBENZENECARBOTHIOYL)MORPHOLINE;Oprea1_220093;DTXSID60303387;SMSF0013457;STK795379;AKOS000353161;CB05736;NSC-158107;BIM-0003826.P001;(2-methoxyphenyl)(morpholin-4-yl)methanethione;SR-01000451018;SR-01000451018-1

Chemical Property of 4-(o-Methoxythiobenzoyl)morpholine

Chemical Property:

• Vapor Pressure: 1.27E-05mmHg at 25°C
• Boiling Point: 368.4°Cat760mmHg
• Flash Point: 176.6°C
• Density: 1.201g/cm³
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 237.08234989
• Heavy Atom Count: 16
• Complexity: 241

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC=C1C(=S)N2CCOCC2

Technology Process of 4-(o-Methoxythiobenzoyl)morpholine

There total 3 articles about 4-(o-Methoxythiobenzoyl)morpholine 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: 92.0%

morpholine (110-91-8,99108-56-2) + ortho-anisaldehyde (135-02-4) → o-Methoxyphenylthiomorpholide (57954-41-3)

Guidance literature:

With sulfur; In neat (no solvent); at 100 ℃; for 4h; Green chemistry;

DOI:10.1007/s00706-017-1944-6

Reference yield:

morpholine (110-91-8,99108-56-2) + 2-Methoxy-benzaldehyde oxime (29577-53-5) → o-Methoxyphenylthiomorpholide (57954-41-3)

Guidance literature:

With sulfur; for 0.116667h; microwave irradiation;

DOI:10.1016/j.tetlet.2004.03.130

Reference yield:

→ o-Methoxyphenylthiomorpholide (57954-41-3)

Guidance literature:

/BRN= 183224/;

upstream raw materials:

morpholine

2-Methoxy-benzaldehyde oxime

ortho-anisaldehyde

Downstream raw materials:

5-Amino-3-(2-methoxyphenyl)-1H-pyrazole-4-carbonitrile

4-[(2-Methoxy-phenyl)-methylsulfanyl-methyl]-morpholine

ortho-anisaldehyde

2-Cyano-3-(2-methoxyphenyl)-3-morpholinoacrylonitrile

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