2-Azido-2-methyl-1-phenyl-1-propanone

Base Information

• Chemical Name: 2-Azido-2-methyl-1-phenyl-1-propanone
• CAS No.: 118887-71-1
• Molecular Formula: C10H11N3O
• Molecular Weight: 189.217
• DSSTox Substance ID: DTXSID301288151
• Mol file: 118887-71-1.mol

Synonyms:2-azido-2-methyl-1-phenyl-1-propanone;118887-71-1;SCHEMBL15139280;IXHRMMWPCNWJQG-UHFFFAOYSA-N;DTXSID301288151;2-azido-2-methyl-1-phenylpropan-1-one;2-Azido-2-methyl-1-phenyl-propan-1-one

Chemical Property of 2-Azido-2-methyl-1-phenyl-1-propanone

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 189.090211983
• Heavy Atom Count: 14
• Complexity: 261

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C(=O)C1=CC=CC=C1)N=[N+]=[N-]

Technology Process of 2-Azido-2-methyl-1-phenyl-1-propanone

There total 12 articles about 2-Azido-2-methyl-1-phenyl-1-propanone 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: 100.0%

2-bromo-2-methyl-1-phenyl-propan-1-one (10409-54-8) → 2-azido-2-methyl-1-phenylpropan-1-one (118887-71-1)

Guidance literature:

With sodium azide; In N,N-dimethyl-formamide; at 20 ℃; for 1h;

Reference yield: 84.0%

2,2-dimethyl-3-phenyl-3-oxopropanoic acid (38744-73-9) → 2-azido-2-methyl-1-phenylpropan-1-one (118887-71-1) + 2-iodo-2-methyl-1-phenylpropan-1-one

Guidance literature:

With sodium azide; dihydrogen peroxide; tetra-(n-butyl)ammonium iodide; In tert-butyl methyl ether; at 25 ℃; for 12h; chemoselective reaction; Catalytic behavior;

DOI:10.1002/anie.202007552

Reference yield: 57.0%

phenyl isopropyl ketone (611-70-1) → 2-azido-2-methyl-1-phenylpropan-1-one (118887-71-1)

Guidance literature:

With Amberlyst A₂₆-resin bound iodine azide; In acetonitrile; at 83 ℃; for 72h; Inert atmosphere;

DOI:10.1039/d1ob00083g

upstream raw materials:

2-bromo-2-methyl-1-phenyl-propan-1-one

phenyl isopropyl ketone

benzaldehyde

tert-butyl 2,2-dimethyl-3-oxo-3-phenylpropanoate

Downstream raw materials:

N-(prop-1-en-2-yl)benzamide

(2-Azido-1-fluoro-2-methyl-propyl)-benzene

2-amino-2-methyl-1-phenyl-propan-1-one p-toluenesulfonate