1-[4-(Morpholine-4-sulfonyl)-phenyl]-ethanone

Base Information

• Chemical Name: 1-[4-(Morpholine-4-sulfonyl)-phenyl]-ethanone
• CAS No.: 58722-35-3
• Molecular Formula: C12H15 N O4 S
• Molecular Weight: 269.321
• Hs Code.: 2935009090
• DSSTox Substance ID: DTXSID40974251
• Wikidata: Q82958460
• Mol file: 58722-35-3.mol

Synonyms:58722-35-3;1-[4-(Morpholine-4-sulfonyl)-phenyl]-ethanone;1-(4-(Morpholinosulfonyl)phenyl)ethanone;1-[4-(morpholine-4-sulfonyl)phenyl]ethan-1-one;1-(4-morpholin-4-ylsulfonylphenyl)ethanone;1-[4-(morpholine-4-sulfonyl)phenyl]ethanone;MFCD00579865;1-[4-(4-morpholinylsulfonyl)phenyl]ethanone;1-(4-(4-MORPHOLINYLSULFONYL)PHENYL)ETHANONE;Cambridge id 5251139;CBDivE_008154;SCHEMBL334552;DTXSID40974251;STK702568;AKOS000267023;NCGC00181898-01;NS-04312;CS-0128003;EU-0011449;1-(4-(Morpholinosulfonyl)phenyl)ethan-1-one;1-[4-(morpholin-4-ylsulfonyl)phenyl]ethanone;EN300-04340;AB00076731-01;SR-01000492759;SR-01000492759-1;Z45515816

Chemical Property of 1-[4-(Morpholine-4-sulfonyl)-phenyl]-ethanone

Chemical Property:

• Vapor Pressure: 3.22E-08mmHg at 25°C
• Melting Point: 155-156 °C
• Boiling Point: 448°C at 760 mmHg
• PKA: -8.18±0.20(Predicted)
• Flash Point: 224.7°C
• PSA: 72.06000
• Density: 1.298g/cm³
• LogP: 1.92880
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 269.07217913
• Heavy Atom Count: 18
• Complexity: 387

Purity/Quality:

97% ^*data from raw suppliers

1-(4-(Morpholinosulfonyl)phenyl)ethanone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 1-[4-(Morpholine-4-sulfonyl)-phenyl]-ethanone

There total 5 articles about 1-[4-(Morpholine-4-sulfonyl)-phenyl]-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: 96.0%

morpholine (110-91-8,99108-56-2) + 4-Acetylbenzenesulfonyl chloride (1788-10-9) → 1-[4-(morpholine-4-sulfonyl)phenyl]ethan-1-one (58722-35-3)

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃;

Reference yield:

morpholine (110-91-8,99108-56-2) + C8H8O3S*C6H15N → 1-[4-(morpholine-4-sulfonyl)phenyl]ethan-1-one (58722-35-3)

Guidance literature:

With sodium hypochlorite; In water; at 20 ℃; for 1.5h; Inert atmosphere; Schlenk technique; Sealed tube;

DOI:10.1055/s-0035-1560578

Reference yield:

morpholine-4-sulfonyl chloride (1828-66-6) + 4-acetylphenylboronic acid (149104-90-5) → 1-[4-(morpholine-4-sulfonyl)phenyl]ethan-1-one (58722-35-3)

Guidance literature:

With disodium hydrogenphosphate; bis(benzonitrile)palladium(II) dichloride; tris(2,6-dimethoxyphenyl)phosphine; In tetrahydrofuran; acetonitrile; at 70 ℃; for 16h;

DOI:10.1039/d1sc01351c

upstream raw materials:

morpholine

4-Acetylbenzenesulfonyl chloride

4-Iodoacetophenone

morpholine-4-sulfonyl chloride

Downstream raw materials:

4-[(4-{4-[(4-CHLOROPHENYL)SULFONYL]PHENYL}PYRIMIDIN-2-YL)AMINO]BENZAMIDE

4-{4-[4-(Morpholine-4-sulfonyl)-phenyl]-pyrimidin-2-ylamino}benzoic Acid

C₂₄H₃₃N₅O₅S

C₁₉H₂₅N₅O₃S