2-Methyl-4-morpholino-6-nitroaniline

Base Information

• Chemical Name: 2-Methyl-4-morpholino-6-nitroaniline
• CAS No.: 468741-20-0
• Molecular Formula: C11H15N3O3
• Molecular Weight: 237.258
• DSSTox Substance ID: DTXSID50469269
• Wikidata: Q82296923
• Mol file: 468741-20-0.mol

Synonyms:2-METHYL-4-MORPHOLINO-6-NITROANILINE;468741-20-0;2-methyl-4-morpholin-4-yl-6-nitroaniline;2-methyl-4-(morpholin-4-yl)-6-nitroaniline;Benzenamine,2-methyl-4-(4-morpholinyl)-6-nitro-;2-methyl-4-morpholino-6-nitrobenzenamine;SCHEMBL5135273;DTXSID50469269;BQZOMWPTJWWTMQ-UHFFFAOYSA-N;AB43905;BP-11949;CS-0359316;FT-0600700;2-Methyl-4-morpholin-4-yl-6-nitro-phenylamine

Chemical Property of 2-Methyl-4-morpholino-6-nitroaniline

Chemical Property:

• Boiling Point: 477.854 °C at 760 mmHg
• Flash Point: 242.798 °C
• PSA: 84.31000
• Density: 1.296 g/cm³
• LogP: 2.49140
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 237.11134135
• Heavy Atom Count: 17
• Complexity: 276

Purity/Quality:

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

2-Methyl-4-morpholino-6-nitrobenzenamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1N)[N+](=O)[O-])N2CCOCC2

Technology Process of 2-Methyl-4-morpholino-6-nitroaniline

There total 1 articles about 2-Methyl-4-morpholino-6-nitroaniline 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: 61.0%

morpholine (110-91-8,99108-56-2) + 4-bromo-2-methyl-6-nitroaniline (77811-44-0) → 2-methyl-4-(morpholin-4-yl)-6-nitroaniline (468741-20-0)

Guidance literature:

With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; johnphos; sodium t-butanolate; In tetrahydrofuran; at 85 ℃; for 18h;

DOI:10.1021/jm050392q

Reference yield: 40.0%

2-methyl-4-(morpholin-4-yl)-6-nitroaniline (468741-20-0) + 2-chloro-5-[(2,6-difluoro-3,5-dimethoxyphenyl)methoxy]pyrimidine (1453211-61-4) → 5-((2,6-difluoro-3,5-dimethoxybenzyl)oxy)-N-(2-methyl-4-morpholino-6-nitrophenyl)pyrimidin-2-amine

Guidance literature:

With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; caesium carbonate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In N,N-dimethyl acetamide; at 100 ℃; for 1.5h; Sealed tube; Inert atmosphere;

Reference yield:

2-methyl-4-(morpholin-4-yl)-6-nitroaniline (468741-20-0) → 3-methyl-5-morpholin-4-yl-benzene-1,2-diamine

Guidance literature:

With hydrogen; palladium on activated charcoal; In methanol; under 3102.89 Torr;

DOI:10.1021/jm050392q

upstream raw materials:

morpholine

4-bromo-2-methyl-6-nitroaniline

Downstream raw materials:

(S)-4-[2-(3-Chloro-phenyl)-2-hydroxy-ethylamino]-3-(4-methyl-6-morpholin-4-yl-1H-benzoimidazol-2-yl)-1H-pyridin-2-one

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