5-Chloro-2-morpholin-4-yl-phenylamine

Base Information

• Chemical Name: 5-Chloro-2-morpholin-4-yl-phenylamine
• CAS No.: 90875-44-8
• Molecular Formula: C10H13ClN2O
• Molecular Weight: 212.679
• European Community (EC) Number: 858-087-3
• DSSTox Substance ID: DTXSID60357168
• Wikidata: Q82136949
• ChEMBL ID: CHEMBL1539547
• Mol file: 90875-44-8.mol

Synonyms:90875-44-8;5-Chloro-2-morpholinoaniline;5-Chloro-2-morpholin-4-yl-phenylamine;5-chloro-2-morpholin-4-ylaniline;5-chloro-2-(morpholin-4-yl)aniline;5-chloro-2-morpholin-4-yl-aniline;(5-chloro-2-morpholin-4-ylphenyl)amine;MLS000048848;5-chloro-2-morpholin-4-ylphenylamine;Benzenamine, 5-chloro-2-(4-morpholinyl)-;SCHEMBL3724717;CHEMBL1539547;DTXSID60357168;UNDBLGNMBLCRNJ-UHFFFAOYSA-N;HMS2318B04;MFCD02934447;STK141093;4-(2-amino-4-chlorophenyl)morpholine;AKOS000103419;5-chloro-2-(4-morpholinyl)phenylamine;SMR000062514;BB 0245141;FT-0677118;EN300-34073;AO-080/15281003;BENZENAMINE,5-CHLORO-2-(4-MORPHOLINYL)-;SR-01000535005;5-chloro-2-morpholin-4-yl-phenylamine, AldrichCPR;SR-01000535005-1;Z56896791

Chemical Property of 5-Chloro-2-morpholin-4-yl-phenylamine

Chemical Property:

• Vapor Pressure: 4.08E-06mmHg at 25°C
• Refractive Index: 1.6
• Boiling Point: 384.5 °C at 760 mmHg
• Flash Point: 186.3 °C
• PSA: 38.49000
• Density: 1.273g/cm³
• LogP: 2.40500
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 212.0716407
• Heavy Atom Count: 14
• Complexity: 185

Purity/Quality:

98%min ^*data from raw suppliers

5-chloro-2-morpholin-4-ylaniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1COCCN1C2=C(C=C(C=C2)Cl)N

Technology Process of 5-Chloro-2-morpholin-4-yl-phenylamine

There total 2 articles about 5-Chloro-2-morpholin-4-yl-phenylamine 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:

4-(4-chloro-2-nitro-phenyl)morpholine (65976-60-5) → 5-chloro-2-morpholinoaniline (90875-44-8)

Guidance literature:

With hydrogenchloride; ethanol; iron;

DOI:10.1039/jr9550003275

Reference yield:

2-fluoro-5-chloronitrobenzene (345-18-6) → 5-chloro-2-morpholinoaniline (90875-44-8)

Guidance literature:

Multi-step reaction with 2 steps

1: potassium carbonate / N,N-dimethyl-formamide / 4 h / 0 - 80 °C

2: zinc; ammonium chloride / ethanol / 16 h / Inert atmosphere; Reflux

With potassium carbonate; ammonium chloride; zinc; In ethanol; N,N-dimethyl-formamide;

DOI:10.1016/j.bioorg.2021.105244

Reference yield: 50.0%

5-chloro-2-morpholinoaniline (90875-44-8) + benzyl alcohol (100-51-6,185532-71-2) → 5-chloro-N-(1,2-diphenylethyl)-2-morpholinoaniline

Guidance literature:

With palladium diacetate; sodium 3-(diphenylphosphanyl)benzenesulfonate; In water; at 120 ℃; for 20h; chemoselective reaction; Sealed tube; Green chemistry;

DOI:10.1039/c7gc03780e

upstream raw materials:

4-(4-chloro-2-nitro-phenyl)morpholine

2-fluoro-5-chloronitrobenzene

Downstream raw materials:

3-hydroxy-[2]naphthoic acid-(5-chloro-2-morpholino-anilide)

5-chloro-2-morpholinophenyl isothiocyanate

1-(n-butyl)-3-(5-chloro-2-morpholinophenyl)thiourea

1-[(2-chloro-4-fluorophenyl)methyl]-4-[5-chloro-2-(4-morpholinyl)phenyl]-2,3-piperazinedione

Refernces