2-Bromo-1-(4-ethylphenyl)ethanone

Base Information

• Chemical Name: 2-Bromo-1-(4-ethylphenyl)ethanone
• CAS No.: 2632-14-6
• Molecular Formula: C10H11 Br O
• Molecular Weight: 227.101
• Hs Code.: 2914700090
• DSSTox Substance ID: DTXSID80496523
• Nikkaji Number: J2.450.596K
• Wikidata: Q82345455
• Mol file: 2632-14-6.mol

Synonyms:2-Bromo-1-(4-ethylphenyl)ethanone;2632-14-6;2-bromo-1-(4-ethylphenyl)ethan-1-one;Ethanone, 2-bromo-1-(4-ethylphenyl)-;2-bromo-4-ethylacetophenone;MFCD00981997;SCHEMBL2776629;DTXSID80496523;XNYSPDGJBPTDDI-UHFFFAOYSA-N;CAA63214;2-Bromo-1-(4-ethylphenyl)-ethanone;AKOS000210262;CS-W006339;1-bromo-2-(4-ethylphenyl)-2-oxoethane;AS-10144;SY114612;2-bromo-1 -(4-ethylphenyl)ethan-1 -one;FT-0702164;A18543;EN300-111042

Chemical Property of 2-Bromo-1-(4-ethylphenyl)ethanone

Chemical Property:

• Melting Point: 33-34 °C
• Boiling Point: 289.4±23.0 °C(Predicted)
• PSA: 17.07000
• Density: 1.360±0.06 g/cm3(Predicted)
• LogP: 2.82660
• Storage Temp.: 2-8°C
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 225.99933
• Heavy Atom Count: 12
• Complexity: 148

Purity/Quality:

98%min ^*data from raw suppliers

2-Bromo-1-(4-ethylphenyl)ethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC=C(C=C1)C(=O)CBr

Technology Process of 2-Bromo-1-(4-ethylphenyl)ethanone

There total 9 articles about 2-Bromo-1-(4-ethylphenyl)ethanone 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%

4-ethylacetophenone (937-30-4) → 4-ethylphenacyl bromide (2632-14-6)

Guidance literature:

With phenyltrimethylammonium tribromide; In tetrahydrofuran; at 0 - 20 ℃; for 1.33333h;

Reference yield: 95.0%

1-bromo-2-(4-ethylphenyl)acetylene (1345683-42-2) → 4-ethylphenacyl bromide (2632-14-6)

Guidance literature:

With water; silver fluoride; trifluoroacetic acid; at 40 ℃; for 6h; Green chemistry;

DOI:10.1016/j.tetlet.2014.01.027

Reference yield: 88.0%

4-ethylacetophenone (937-30-4) → 4-ethylphenacyl bromide (2632-14-6) + 2,2-dibromo-1-(4-ethylphenyl)ethan-1-one (41036-98-0)

Guidance literature:

With N-Bromosuccinimide; silica gel; In methanol; for 0.266667h; chemoselective reaction; Reflux;

DOI:10.1016/j.cclet.2013.09.014

upstream raw materials:

ethylbenzene

2-Bromoacetyl bromide

4-ethylacetophenone

1-bromo-2-(4-ethylphenyl)acetylene

Downstream raw materials:

6-(4-ethylphenyl)-2-methylpyrrolo[1,2-b]pyridazine

2-(4-Ethyl-phenyl)-6-methyl-7-phenyl-indolizine

1-[2-(4-ethylphenyl)-2-oxoethyl]-4-{6-fluoro-5-[(methylamino)carbonyl]-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl}piperidinium chloride

2-amino-4-(4'-ethylphenyl)-thiazole

Refernces

• 1、 Grjol, Bla?,Jereb, Marjan. "Reactivity of substrates with multiple competitive reactive sites toward NBS under neat reaction conditions promoted by visible light". . p. 5235 - 5248. Retrieved 2021/06/07.
• 2、 Ye, Zhiwen,Liu, Chunxia,Zou, Feng,Cai, Yan,Chen, Bin,Zou, Yuxing,Mo, Jiaxian,Han, Ting,Huang, Wenlong,Qiu, Qianqian,Qian, Hai. "Discovery of novel potent GPR40 agonists containing imidazo[1,2-a]pyridine core as antidiabetic agents". . . Retrieved 2020/06/19.