Coumarin, 4-morpholino-3-nitro-

Base Information

• Chemical Name: Coumarin, 4-morpholino-3-nitro-
• CAS No.: 50527-34-9
• Molecular Formula: C13H12N2O5
• Molecular Weight: 276.2448
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID00198537
• Nikkaji Number: J67.697G
• Wikidata: Q83071304
• ChEMBL ID: CHEMBL1320416
• Mol file: 50527-34-9.mol

Synonyms:50527-34-9;4-morpholin-4-yl-3-nitrochromen-2-one;4-Morpholino-3-nitro-2H-chromen-2-one;COUMARIN, 4-MORPHOLINO-3-NITRO-;4-Morpholino-3-nitrocoumarin;4-(morpholin-4-yl)-3-nitro-2H-chromen-2-one;4-morpholin-4-yl-3-nitro-2H-chromen-2-one;BRN 1149025;3-nitro-4-(4-morpholinyl)-2H-chromen-2-one;MLS000856311;CHEMBL1320416;DTXSID00198537;HMS2690M12;STK997283;4-morpholinyl-3-nitro-chromen-2-one;AKOS000636259;NCGC00245226-01;LS-55262;SMR000279256;CS-0243281;4-Morpholino-3-nitro-2H-1-benzopyran-2-one;EN300-26185;AB00074758-01;AH-262/31957059;SR-01000390137;SR-01000390137-1;Z57066946

Chemical Property of Coumarin, 4-morpholino-3-nitro-

Chemical Property:

• Vapor Pressure: 9.8E-08mmHg at 25°C
• Boiling Point: 434°Cat760mmHg
• Flash Point: 216.3°C
• PSA: 88.50000
• Density: 1.46g/cm³
• LogP: 2.12600
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 276.07462149
• Heavy Atom Count: 20
• Complexity: 450

Purity/Quality:

97% ^*data from raw suppliers

4-Morpholino-3-nitro-2H-chromen-2-one 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCCN1C2=C(C(=O)OC3=CC=CC=C32)[N+](=O)[O-]

Technology Process of Coumarin, 4-morpholino-3-nitro-

There total 1 articles about Coumarin, 4-morpholino-3-nitro- 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:

morpholine (110-91-8,99108-56-2) + 4-chloro-3-nitro-chromen-2-one (38464-20-9) → 4-morpholin-4-yl-3-nitro-chromen-2-one (50527-34-9)

Guidance literature:

DOI:10.1007/BF00471556

Reference yield:

4-morpholin-4-yl-3-nitro-chromen-2-one (50527-34-9) → 3-Amino-4-morpholinocumarin (59288-16-3)

Guidance literature:

With hydrogen; palladium on barium sulfate;

DOI:10.1007/BF00479561

upstream raw materials:

morpholine

4-chloro-3-nitro-chromen-2-one

Downstream raw materials:

3-Amino-4-morpholinocumarin