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38861-78-8

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38861-78-8 Usage

Chemical Properties

Clear Colourless Oil

Uses

Different sources of media describe the Uses of 38861-78-8 differently. You can refer to the following data:
1. 4'-isobutylacetophenone is an important starting material employed in the production of pharmaceuticals such as ibuprofen. It is also utilized in proteomics research. It is used as an intermediate in organic synthesis.
2. A degradation product of Ibuprofen in tablets, which is a known toxin. Ibuprofen (I140000) impuritiy.

Preparation

Synthesis of 4-isobutylacetophenone: toluene and propylene are reacted with the participation of metal potassium, sodium carbonate and graphite, Alkylation on methyl to generate isobutylbenzene, Then with acetyl chloride in the participation of anhydrous aluminum trichloride to obtain the product.

Check Digit Verification of cas no

The CAS Registry Mumber 38861-78-8 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 3,8,8,6 and 1 respectively; the second part has 2 digits, 7 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 38861-78:
(7*3)+(6*8)+(5*8)+(4*6)+(3*1)+(2*7)+(1*8)=158
158 % 10 = 8
So 38861-78-8 is a valid CAS Registry Number.
InChI:InChI=1/C12H16O/c1-9(2)12(10(3)13)11-7-5-4-6-8-11/h4-9,12H,1-3H3

38861-78-8 Well-known Company Product Price

  • Brand
  • (Code)Product description
  • CAS number
  • Packaging
  • Price
  • Detail
  • Alfa Aesar

  • (A10624)  4'-Isobutylacetophenone, 97%   

  • 38861-78-8

  • 50g

  • 549.0CNY

  • Detail
  • Alfa Aesar

  • (A10624)  4'-Isobutylacetophenone, 97%   

  • 38861-78-8

  • 250g

  • 1258.0CNY

  • Detail
  • Sigma-Aldrich

  • (PHR1146)  4′-Isobutylacetophenone  pharmaceutical secondary standard; traceable to USP and BP

  • 38861-78-8

  • PHR1146-500MG

  • 1,024.57CNY

  • Detail
  • USP

  • (1335541)  Ibuprofen Related Compound C  United States Pharmacopeia (USP) Reference Standard

  • 38861-78-8

  • 1335541-3X0.2ML

  • 14,320.80CNY

  • Detail

38861-78-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name 4'-(2-Methylpropyl)acetophenone

1.2 Other means of identification

Product number -
Other names 1-[4-(2-methylpropyl)phenyl]ethanone

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:38861-78-8 SDS

38861-78-8Relevant articles and documents

Degradation of ibuprofen by hydrodynamic cavitation: Reaction pathways and effect of operational parameters

Musmarra, Dino,Prisciandaro, Marina,Capocelli, Mauro,Karatza, Despina,Iovino, Pasquale,Canzano, Silvana,Lancia, Amedeo

, p. 76 - 83 (2016)

Ibuprofen (IBP) is an anti-inflammatory drug whose residues can be found worldwide in natural water bodies resulting in harmful effects to aquatic species even at low concentrations. This paper deals with the degradation of IBP in water by hydrodynamic cavitation in a convergent-divergent nozzle. Over 60% of ibuprofen was degraded in 60 min with an electrical energy per order (EEO) of 10.77 kWh m-3 at an initial concentration of 200 μg L-1 and a relative inlet pressure pin = 0.35 MPa. Five intermediates generated from different hydroxylation reactions were identified; the potential mechanisms of degradation were sketched and discussed. The reaction pathways recognized are in line with the relevant literature, both experimental and theoretical. By varying the pressure upstream the constriction, different degradation rates were observed. This effect was discussed according to a numerical simulation of the hydroxyl radical production identifying a clear correspondence between the maximum kinetic constant kOH and the maximum calculated OH production. Furthermore, in the investigated experimental conditions, the pH parameter was found not to affect the extent of degradation; this peculiar feature agrees with a recently published kinetic insight and has been explained in the light of the intermediates of the different reaction pathways.

Silicon nanowires as photoelectrodes for carbon dioxide fixation

Liu, Rui,Yuan, Guangbi,Joe, Candice L.,Lightburn, Thomas E.,Tan, Kian L.,Wang, Dunwei

, p. 6709 - 6712 (2012)

Lights on: When illuminated, p-type Si nanowires donate photogenerated electrons to aromatic ketones, producing reactive radicals that can harvest CO2 to yield α-hydroxy acids (see scheme). The reaction scheme closely resembles that of natural photosynthesis and gives up to 98 % yield and selectivity. Products obtained by this reaction include important precursors for nonsteroidal anti-inflammatory drugs, such as ibuprofen and naproxen. Copyright

Oxidative Cleavage of Alkenes by O2with a Non-Heme Manganese Catalyst

Bennett, Elliot L.,Brookfield, Adam,Guan, Renpeng,Huang, Zhiliang,Mcinnes, Eric J. L.,Robertson, Craig M.,Shanmugam, Muralidharan,Xiao, Jianliang

supporting information, p. 10005 - 10013 (2021/07/19)

The oxidative cleavage of C═C double bonds with molecular oxygen to produce carbonyl compounds is an important transformation in chemical and pharmaceutical synthesis. In nature, enzymes containing the first-row transition metals, particularly heme and non-heme iron-dependent enzymes, readily activate O2 and oxidatively cleave C═C bonds with exquisite precision under ambient conditions. The reaction remains challenging for synthetic chemists, however. There are only a small number of known synthetic metal catalysts that allow for the oxidative cleavage of alkenes at an atmospheric pressure of O2, with very few known to catalyze the cleavage of nonactivated alkenes. In this work, we describe a light-driven, Mn-catalyzed protocol for the selective oxidation of alkenes to carbonyls under 1 atm of O2. For the first time, aromatic as well as various nonactivated aliphatic alkenes could be oxidized to afford ketones and aldehydes under clean, mild conditions with a first row, biorelevant metal catalyst. Moreover, the protocol shows a very good functional group tolerance. Mechanistic investigation suggests that Mn-oxo species, including an asymmetric, mixed-valent bis(μ-oxo)-Mn(III,IV) complex, are involved in the oxidation, and the solvent methanol participates in O2 activation that leads to the formation of the oxo species.

Hydroxylamine promoted Fe(III)/Fe(II) cycle on ilmenite surface to enhance persulfate catalytic activation and aqueous pharmaceutical ibuprofen degradation

Yin, Ran,Hu, Lingling,Xia, Dehua,Yang, Jingling,He, Chun,Liao, Yuhong,Zhang, Qing,He, Jia

, p. 294 - 302 (2019/05/10)

This study demonstrates a new system for the degradation of emerging pharmaceutical contaminants (e.g., ibuprofen) in water by coupling the naturally occurring ilmenite with hydroxylamine (HA) and persulfate (PS). Ilmenite was able to activate persulfate to generate sulfate radicals (SO4?·) and hydroxyl radicals (HO·). The radical generation was greatly improved by adding small amount of hydroxylamine into the solution, due to the efficient Fe(III)/Fe(II) cycle on the ilmenite surface promoted by HA, which was confirmed by X-ray photoelectron spectroscopy and electron paramagnetic resonance (EPR) spectroscopy analysis. SO4?· and HO· contributed comparably to ibuprofen degradation, which was verified by the radical scavenging tests. The degradation was enhanced with increasing ilmenite, PS and HA dosages, but the HA exhibited strong scavenging effect at its high concentrations. The ilmenite/PS/HA process worked well in the real treated wastewater, because the surface-controlled radical generation was less affected by the water matrix. However, the formation of bromate in the bromide-containing water by this process should be concerned. Ibuprofen was partially mineralized, and the degradation products were identified by ESI-tqMS. A radical-induced degradation pathway was proposed based on the product identification. This work provides the mechanistic insights on persulfate activation based on the surface-controlled catalytic processes. It also offers a new strategy to degrade emerging contaminants in water and sheds light on the environmental functions of natural minerals.

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