1-Butanone, 1-(2-aminophenyl)-2-methyl-

Base Information

• Chemical Name: 1-Butanone, 1-(2-aminophenyl)-2-methyl-
• CAS No.: 56514-73-9
• Molecular Formula: C11H15NO
• Molecular Weight: 177.246
• DSSTox Substance ID: DTXSID20485830

Synonyms:1-Butanone, 1-(2-aminophenyl)-2-methyl-;56514-73-9;SCHEMBL11841637;DTXSID20485830;AKOS017529649

Chemical Property of 1-Butanone, 1-(2-aminophenyl)-2-methyl-

Chemical Property:

• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 177.115364102
• Heavy Atom Count: 13
• Complexity: 179

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)C(=O)C1=CC=CC=C1N

Technology Process of 1-Butanone, 1-(2-aminophenyl)-2-methyl-

There total 2 articles about 1-Butanone, 1-(2-aminophenyl)-2-methyl- 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:

anthranilic acid nitrile (1885-29-6) → 1-(2-aminophenyl)-2,2-dimethylpropan-1-one (56514-73-9)

Guidance literature:

With copper(l) iodide; In tetrahydrofuran; at 20 ℃;

DOI:10.1016/j.bmcl.2004.08.010

Reference yield:

→ 1-(2-aminophenyl)-2,2-dimethylpropan-1-one (56514-73-9)

Guidance literature:

Alkylhalogenid, Mg, o-Aminobenzonitril;

Reference yield: 90.0%

1-(2-aminophenyl)-2,2-dimethylpropan-1-one (56514-73-9) + benzylamine (100-46-9) → C18H18N2 (1315578-05-2)

Guidance literature:

With TEMPOL; oxygen; In o-xylene; at 120 ℃; for 12h; under 760.051 Torr; Inert atmosphere;

DOI:10.1039/c1cc12308d

upstream raw materials:

anthranilic acid nitrile

Downstream raw materials:

2-(2-Methyl-butyryl)-benzenediazonium

o-azidophenyl s-butyl ketone

C₁₈H₁₈N₂

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