2-Morpholinoaniline

Base Information

• Chemical Name: 2-Morpholinoaniline
• CAS No.: 5585-33-1
• Molecular Formula: C10H14 N2 O
• Molecular Weight: 178.234
• Hs Code.: 2934999090
• European Community (EC) Number: 627-396-3
• UNII: PB36FZG3HN
• DSSTox Substance ID: DTXSID30352822
• Nikkaji Number: J1.107.064G
• Wikidata: Q82130200
• ChEMBL ID: CHEMBL1333997
• Mol file: 5585-33-1.mol

Synonyms:2-Morpholinoaniline;5585-33-1;2-Morpholin-4-yl-phenylamine;2-morpholin-4-ylaniline;2-(morpholin-4-yl)aniline;2-(4-Morpholino)aniline;2-(4-Morpholinyl)aniline;4-(2-Aminophenyl)morpholine;n-(2-aminophenyl)morpholine;MFCD00047408;Benzenamine, 2-(4-morpholinyl)-;2-morpholinobenzenamine;Enamine_000782;(2-Morpholinophenyl)amine;PB36FZG3HN;2-Morpholinoaniline, 97%;Oprea1_339853;Oprea1_607645;MLS000556407;2-(4-Morpholinyl)benzenamine;SCHEMBL127620;(2-morpholin-4-ylphenyl)amine;N-(2-amino-phenyl) morpholine;CHEMBL1333997;Morpholine, 4-(o-aminophenyl)-;DTXSID30352822;QKWLVAYDAHQMLG-UHFFFAOYSA-N;HMS1396D12;HMS2384G11;STR01982;AC7767;STK088113;AKOS000103049;SDCCGMLS-0065842.P001;11G-330S;SMR000147724;SY013914;BB 0245672;CS-0127962;FT-0608680;M2671;EN300-30032;A830840;J-510127;Z56785490;1-[(2,4,6-trimethylphenyl)methyl]-1,4-diazepane;LWV

Chemical Property of 2-Morpholinoaniline

Chemical Property:

• Vapor Pressure: 0.000146mmHg at 25°C
• Melting Point: 93-95°C
• Boiling Point: 332.5°C at 760 mmHg
• PKA: 7.26±0.40(Predicted)
• Flash Point: 154.9°C
• PSA: 38.49000
• Density: 1.149g/cm³
• LogP: 1.75160
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 178.110613074
• Heavy Atom Count: 13
• Complexity: 157

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-Morpholinoaniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xi,Xn
• Statements: 20/21/22-36/37/38-22
• Safety Statements: 26-36/37/39-36/37

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1COCCN1C2=CC=CC=C2N

Technology Process of 2-Morpholinoaniline

There total 18 articles about 2-Morpholinoaniline 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: 99.0%

N-(2-morpholinophenyl)picolinamide (775316-48-8) → 2-morpholinoaniline (5585-33-1)

Guidance literature:

With sodium hydroxide; In ethanol; at 70 ℃; for 5h;

DOI:10.1021/acs.orglett.9b01546

Reference yield: 95.0%

morpholine (110-91-8,99108-56-2) + 2-bromoaniline (615-36-1) → 2-morpholinoaniline (5585-33-1)

Guidance literature:

With ⁽⁵⁵⁾Pd₀₆₈⁽⁴⁴⁾Ni₀₃₂; potassium carbonate; In water; at 50 ℃; for 5h; Catalytic behavior;

DOI:10.1039/c4ra06958g

Reference yield: 93.0%

N-(2-nitrophenyl)morpholine (5320-98-9) → 2-morpholinoaniline (5585-33-1)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In methanol; at 20 ℃; for 5h; under 760.051 Torr;

DOI:10.1021/acs.jmedchem.7b00468

upstream raw materials:

N-(2-nitrophenyl)morpholine

2-Chloronitrobenzene

2-morpholin-4-yl-N-(pivaloyloxy)benzamide

N-(pivaloyloxy)benzamide

Downstream raw materials:

2,2'-(2-morpholin-4-yl-phenylazanediyl)-bis-ethanol

3,4-dihydro-1H-benzo[4,5]imidazo[2,1-c][1,4]oxazine

3-[(2-morpholin-4-ylphenyl)hydrazono]pentane-2,4-dione

6-bromo-2-phenyl-3-(2'-morpholinophenyl)quinazolin-4(3H)-one

Refernces

• 1、 Kang, Qi-Kai,Li, Yuntong,Lin, Yunzhi,Shi, Hang. "Ru(II)-Catalyzed Amination of Aryl Fluorides via η6-Coordination". supporting information. p. 3706 - 3711. Retrieved 2020/03/11.
• 2、 Wu, Peng,Huang, Wei,Cheng, Tai-Jin,Lin, Hai-Xia,Xu, Hui,Dai, Hui-Xiong. "Copper-Catalyzed Oxalamide-Directed ortho-C-H Amination of Anilines with Alkylamines". supporting information. p. 5051 - 5056. Retrieved 2020/07/04.