4-(4-Bromophenylsulfonyl)morpholine

Base Information

• Chemical Name: 4-(4-Bromophenylsulfonyl)morpholine
• CAS No.: 834-67-3
• Molecular Formula: C10H12BrNO3S
• Molecular Weight: 306.18
• Hs Code.: 2934999090
• European Community (EC) Number: 805-435-7
• NSC Number: 75610
• DSSTox Substance ID: DTXSID70291448
• Nikkaji Number: J2.739.163J
• Wikidata: Q82029409
• ChEMBL ID: CHEMBL4552851
• Mol file: 834-67-3.mol

Synonyms:4-(4-bromophenylsulfonyl)morpholine;834-67-3;4-(4-bromobenzenesulfonyl)morpholine;4-((4-Bromophenyl)sulfonyl)morpholine;4-(4-bromophenyl)sulfonylmorpholine;4-[(4-bromophenyl)sulfonyl]morpholine;4-[(4-Bromobenzene)sulfonyl]morpholine;NSC75610;4-(4-Bromo-benzenesulfonyl)-morpholine;4-[(4-Bromophenyl)sulphonyl]morpholine;NCIOpen2_008551;SCHEMBL289534;CHEMBL4552851;NIOSH/QD8560500;DTXSID70291448;HMS1693B06;N-(4-bromobenzenesulfonyl)morpholine;MFCD00194739;NSC 75610;NSC-75610;STK020045;N-(4 -bromobenzenesulfonyl)morpholine;4-((p-Bromophenyl)sulfonyl)morpholine;AKOS000383507;AB04664;AM87223;AS-2005;NCGC00181870-01;LS-92474;Morpholine, 4-((p-bromophenyl)sulfonyl)-;CS-0208443;FT-0727872;QD85605000;F15461;A840581;SR-01000509975;SR-01000509975-1;Z45515782;4-Bromobenzenesulfonyl morpholine

Chemical Property of 4-(4-Bromophenylsulfonyl)morpholine

Chemical Property:

• Vapor Pressure: 4.03E-07mmHg at 25°C
• Melting Point: 140-142
• Refractive Index: 1.596
• Boiling Point: 415.7 °C at 760 mmHg
• Flash Point: 205.2 °C
• PSA: 54.99000
• Density: 1.594 g/cm³
• LogP: 2.48870
• Storage Temp.: 2-8°C
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 304.97213
• Heavy Atom Count: 16
• Complexity: 313

Purity/Quality:

97% ^*data from raw suppliers

4-(4-Bromophenylsulfonyl)morpholine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCCN1S(=O)(=O)C2=CC=C(C=C2)Br

Technology Process of 4-(4-Bromophenylsulfonyl)morpholine

There total 11 articles about 4-(4-Bromophenylsulfonyl)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: 100.0%

morpholine (110-91-8,99108-56-2) + 4-bromobenzenesulfonyl chloride (98-58-8) → 4-((4-bromophenyl)sulfonyl)morpholine (834-67-3)

Guidance literature:

With pyridine; In dichloromethane; at 20 ℃; for 1h;

DOI:10.1016/j.bmcl.2007.04.110

Reference yield: 100.0%

→ 4-((4-bromophenyl)sulfonyl)morpholine (834-67-3)

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃; for 1h;

Reference yield: 99.0%

4-(benzoyloxy)morpholine (5765-65-1) + sodium 4-bromobenzenesulfinate (34176-08-4) → 4-((4-bromophenyl)sulfonyl)morpholine (834-67-3)

Guidance literature:

4-(benzoyloxy)morpholine; sodium 4-bromobenzenesulfinate; In 1,2-dichloro-ethane; at 30 ℃; for 12h; Schlenk technique; Inert atmosphere;

With copper(ll) bromide; In 1,2-dichloro-ethane; for 12h; Schlenk technique; Inert atmosphere;

DOI:10.1039/c5cc06069a

upstream raw materials:

morpholine

4-bromobenzenesulfonyl chloride

4-bromo-benzenesulfonic acid ethyl ester

sodium 4-bromobenzenesulfinate

Downstream raw materials:

[(4-N-morpholine-4-sulfonyl)phenyl]boronic acid

(S)-tert-butyl 4-(1-amino-3-(4'-(morpholinosulfonyl)biphenyl-4-yl)-1-oxopropan-2-ylcarbamoyl)tetrahydro-2H-pyran-4-ylcarbamate

Refernces

• 1、 Polites, Viktor C.,Badir, Shorouk O.,Keess, Sebastian,Jolit, Anais,Molander, Gary A.. "Nickel-Catalyzed Decarboxylative Cross-Coupling of Bicyclo[1.1.1]pentyl Radicals Enabled by Electron Donor-Acceptor Complex Photoactivation". supporting information. p. 4828 - 4833. Retrieved 2021/06/30.
• 2、 -. "Synthesis method of sulfonyl secondary amine compound". Paragraph 0037-0041. . Retrieved 2021/04/21.