2'-Methyl-2-phenylacetophenone

Base Information

• Chemical Name: 2'-Methyl-2-phenylacetophenone
• CAS No.: 16216-13-0
• Molecular Formula: C15H14O
• Molecular Weight: 210.276
• Hs Code.: 2914399090
• DSSTox Substance ID: DTXSID70425049
• Nikkaji Number: J741.600H
• Wikidata: Q82237798
• Mol file: 16216-13-0.mol

Synonyms:2'-Methyl-2-phenylacetophenone;16216-13-0;1-(2-methylphenyl)-2-phenylethanone;2-Methyldeoxybenzoin;2'Methyl-2-phenylacetophenone;MFCD02260669;Methyldesoxybenzoin;CBiol_000843;2-phenyl-1-o-tolylethanone;CBiol_000840;2-phenyl-1-(o-tolyl)ethanone;SCHEMBL1515738;DTXSID70425049;XZHWEJVJMHRXPP-UHFFFAOYSA-N;ICCB4_000136;ICCB4_000139;AKOS010014267;2/'-METHYL-2-PHENYLACETOPHENONE;1-(2-Methylphenyl)-2-phenylethan-1-one

Chemical Property of 2'-Methyl-2-phenylacetophenone

Chemical Property:

• Vapor Pressure: 0.000105mmHg at 25°C
• Boiling Point: 337.5oC at 760 mmHg
• Flash Point: 144.8oC
• PSA: 17.07000
• Density: 1.062g/cm3
• LogP: 3.42040
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 210.104465066
• Heavy Atom Count: 16
• Complexity: 228

Purity/Quality:

98%min ^*data from raw suppliers

2'Methyl-2-phenylacetophenone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=CC=C1C(=O)CC2=CC=CC=C2

Technology Process of 2'-Methyl-2-phenylacetophenone

There total 48 articles about 2'-Methyl-2-phenylacetophenone 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%

2-Methylphenylboronic acid (16419-60-6) + phenylacetonitrile (140-29-4) → 2-phenyl-1-o-tolylethanone (16216-13-0)

Guidance literature:

With ammonium chloride; bipyridine-cyclopalladated ferrocenylimine complex; In water; at 100 ℃; for 24h;

DOI:10.1055/s-2007-992359

Reference yield: 89.0%

1-(2-methylphenyl)-2-phenylethanol (22817-11-4) → 2-phenyl-1-o-tolylethanone (16216-13-0)

Guidance literature:

With dipyridinium dichromate; In dichloromethane;

DOI:10.1021/jo040173x

Reference yield: 81.0%

1,3-Diphenylpropanone (102-04-5) → 2-phenyl-1-o-tolylethanone (16216-13-0) + 1,1'-(1,2-ethanediyl)bisbenzene (103-29-7) + 2-phenyl-1-p-tolyl-ethanone (2001-28-7)

Guidance literature:

Irradiation; on LiX zeolite, in presence of 2000 G magnetic fild;

DOI:10.1016/S0040-4039(01)80648-1

upstream raw materials:

ortho-methylbenzoic acid

phenylacetic acid

ethanedinitrile

benzylmagnesium chloride

Downstream raw materials:

2,3-diphenyl-2-butanol

o-methylbenzil

1-chloro-1,2-diphenyl-propene

2-bromo-2-phenyl-1-(o-tolyl)ethanone