1-(5-Morpholino-2-nitrophenyl)-1-ethanone

Base Information

• Chemical Name: 1-(5-Morpholino-2-nitrophenyl)-1-ethanone
• CAS No.: 98440-51-8
• Molecular Formula: C₁₂H₁₄N₂O₄
• Molecular Weight: 250.254
• DSSTox Substance ID: DTXSID101264006
• ChEMBL ID: CHEMBL1500915

Synonyms:98440-51-8;1-(5-morpholino-2-nitrophenyl)-1-ethanone;1-[5-(morpholin-4-yl)-2-nitrophenyl]ethan-1-one;1-(5-morpholin-4-yl-2-nitrophenyl)ethanone;MLS000763813;SCHEMBL341354;CHEMBL1500915;DTXSID101264006;HMS2706B17;MFCD03787323;AKOS005090781;SMR000336445;1-[5-(4-Morpholinyl)-2-nitrophenyl]ethanone;3W-0356

Chemical Property of 1-(5-Morpholino-2-nitrophenyl)-1-ethanone

Chemical Property:

• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 250.09535693
• Heavy Atom Count: 18
• Complexity: 323

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)C1=C(C=CC(=C1)N2CCOCC2)[N+](=O)[O-]

Technology Process of 1-(5-Morpholino-2-nitrophenyl)-1-ethanone

There total 1 articles about 1-(5-Morpholino-2-nitrophenyl)-1-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:

3'-Chloroacetophenone (99-02-5) → 2'-nitro-5'-(morpholin-4-yl)acetophenone (98440-51-8)

Guidance literature:

Multi-step reaction with 2 steps

1: conc. H₂SO₄, HNO₃

With sulfuric acid; nitric acid;

DOI:10.1021/jm00046a025

Reference yield: 94.6%

2'-nitro-5'-(morpholin-4-yl)acetophenone (98440-51-8) → 1-(2-amino-5-morpholinophenyl)-1-ethanone (98440-50-7)

Guidance literature:

With hydrogen; palladium 10% on activated carbon; In dichloromethane; at 25 ℃; for 8h;

Reference yield: 88.12%

benzaldehyde (100-52-7) + 2'-nitro-5'-(morpholin-4-yl)acetophenone (98440-51-8) → 1-[5-(morpholin-4-yl)-2-nitrophenyl]-3-phenylprop-2-en-1-one (1339010-06-8)

Guidance literature:

With sodium hydroxide; In ethanol; water; at 20 ℃; for 2h;

DOI:10.1016/j.bmc.2011.07.029

upstream raw materials:

3'-Chloroacetophenone

Downstream raw materials:

1-(2-amino-5-morpholinophenyl)-1-ethanone

N-(2-Acetyl-4-morpholin-4-yl-phenyl)-3-methoxy-benzamide

1-[5-(morpholin-4-yl)-2-nitrophenyl]-3-phenylprop-2-en-1-one

1-[5-(morpholin-4-yl)-2-benzoylaminophenyl]-3-phenylpropan-1-one

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