54549-72-3

Usage

Uses

Used in Fragrance Industry:
1-[4-(2-hydroxypropan-2-yl)phenyl]ethanone is used as a fragrance ingredient for its sweet floral scent, contributing to the formulation of perfumes and other cosmetic products. Its pleasant aroma makes it a valuable addition to the fragrance industry.
Used in Pharmaceutical Industry:
As an intermediate in the synthesis of pharmaceuticals, 1-[4-(2-hydroxypropan-2-yl)phenyl]ethanone plays a crucial role in the development of various medicinal compounds. Its chemical structure allows for its use in creating a range of therapeutic agents.
Used in Organic Synthesis:
1-[4-(2-hydroxypropan-2-yl)phenyl]ethanone is utilized as an intermediate in the synthesis of other organic compounds, showcasing its versatility in organic chemistry and its ability to contribute to the creation of a wide array of products.
Used in Anti-Inflammatory and Antioxidant Research:
1-[4-(2-hydroxypropan-2-yl)phenyl]ethanone has been studied for its potential as an anti-inflammatory and antioxidant agent, indicating its possible use in the development of treatments for conditions related to inflammation and oxidative stress.
However, it is important to handle 1-[4-(2-hydroxypropan-2-yl)phenyl]ethanone with care due to its potential to cause irritation to the skin, eyes, and respiratory system, emphasizing the need for proper safety measures during its use in various applications.

InChI:InChI=1/C11H14O2/c1-8(12)9-4-6-10(7-5-9)11(2,3)13/h4-7,13H,1-3H3

Upstream product

• 80-15-9 Cumene hydroperoxide 
• 645-13-6 4-isopropylacetophenone 
• 583-05-1 1-phenylpentane-1,4-dione 
• 5359-04-6 1-(4-(prop-1-en-2-yl)phenyl)ethan-1-one 
• 4360-68-3 2-(4-bromophenyl)-2-methyl-1,3-dioxolane 
• 67-64-1 acetone 
• 99-90-1 para-bromoacetophenone 
• 373-53-5 fluoroiodomethane 
• 203442-83-5 methyl 4-(N-methoxy-N-methylcarbamoyl)benzoate 
• 7377-26-6 4-Methoxycarbonylbenzoyl chloride 
• 3609-53-8 methyl 4-acetylbenzoate 
• 75-16-1 methylmagnesium bromide 
• 78906-11-3 2-methyl-2-(4-methoxycarbonylphenyl)-1,3-dioxolan 
• 586-89-0 4-acetyl-benzoic acid 

Downstream Products

• 5359-04-6 1-(4-(prop-1-en-2-yl)phenyl)ethan-1-one 
• 64253-31-2 1-(2-hydroperoxy-1-methylethyl)-4-acetylbenzene 
• 79506-32-4 1-(1-methyl-1-tert-butylperoxyethyl)-4-acetylbenzene 
• 79506-35-7 1-methyl-1-(4-carboxyphenyl)ethyl tert-butyl peroxide 
• 110726-28-8 4,4'-(1-(4 (2-(4-hydroxyphenyl)propane-2-yl)phenyl)ethane-1,1-diyl)bis(phenol) 
• 110726-34-6 4,4'-(1-(4-(2-(4-hydroxy-3-methylphenyl)propan-2-yl)phenyl)ethane-1,1-diyl)bis(2-methylphenol) 

Relevant academic research and scientific papers

Non-Heme-Type Ruthenium Catalyzed Chemo- and Site-Selective C?H Oxidation

Herein, we developed a Ru(II)(BPGA) complex that could be used to catalyze chemo- and site-selective C?H oxidation. The described ruthenium complex was designed by replacing one pyridyl group on tris(2-pyridylmethyl)amine with an electron-donating amide ligand that was critical for promoting this type of reaction. More importantly, higher reactivities and better chemo-, and site-selectivities were observed for reactions using the cis-ruthenium complex rather than the trans-one. This reaction could be used to convert sterically less hindered methyne and/or methylene C?H bonds of a various organic substrates, including natural products, into valuable alcohol or ketone products.

Method for synthesizing tertiary alcohol by catalytically oxidizing benzyl tertiary C-H bonds of aromatic hydrocarbon through metalloporphyrin

The invention discloses a method for synthesizing tertiary alcohol by catalytically oxidizing benzyl tertiary C-H bonds of aromatic hydrocarbon through metalloporphyrin. The method comprises the following steps: dispersing metalloporphyrin (1*10-1%, mol/mol) into aromatic hydrocarbon; sealing the reaction system, heating to 40-120 DEG C while stirring, introducing an oxidant (0.10-1.0 MPa), keeping the set temperature and pressure, carrying out reactions for 3.0-24.0 hours under stirring, and carrying out after-treatment on the reaction solution to obtain the product aromatic benzyl tertiary alcohol. The method has the advantages of shortest conversion path, highest atom economy, lower reaction temperature, lower environmental influence and the like, and the selectivity of aromatic benzyl tertiary alcohol is high. In addition, the content of aromatic hydrocarbon hydroperoxide is low, and the safety coefficient is high. The invention provides an efficient, feasible and safe method for synthesizing aromatic benzyl tertiary alcohol through selective catalytic oxidation of benzyl tertiary C-H bonds of aromatic hydrocarbon.

COMPOUNDS FOR THE REDUCTION OF THE DELETERIOUS ACTIVITY OF EXTENDED NUCLEOTIDE REPEAT CONTAINING GENES

Aspects of the present disclosure include methods of reducing the deleterious impact of a target gene in a cell, such as the deleterious activity of a mutant extended nucleotide repeat (NR) containing target gene in a cell by contacting the cell with an effective amount of a tetrahydrocarbazole compound. The deleterious activity (e.g., toxicity and/or dis-functionality of products encoded thereby) of a mutant extended NR containing target gene may be reduced, e.g., by reducing (and in some instances differentially, including selectively, reducing) the production or activity of toxic expression products (e.g., RNA or protein) encoded by the target gene. Kits and compositions for practicing the subject methods are also provided.

Fluoro-Substituted Methyllithium Chemistry: External Quenching Method Using Flow Microreactors

The external quenching method based on flow microreactors allows the generation and use of short-lived fluoro-substituted methyllithium reagents, such as fluoromethyllithium, fluoroiodomethyllithium, and fluoroiodostannylmethyllithium. Highly chemoselective reactions have been developed, opening new opportunities in the synthesis of fluorinated molecules using fluorinated organometallics.

Efficient and selective oxidation of tertiary benzylic C[sbnd]H bonds with O2 catalyzed by metalloporphyrins under mild and solvent-free conditions

The direct and efficient oxidation of tertiary benzylic C[sbnd]H bonds to alcohols with O2 was accomplished in the presence of metalloporphyrins as catalysts under solvent-free and additive-free conditions. Based on effective inhibition on the unselective autoxidation and deep oxidation, systematical investigation on the effects of porphyrin ligands and metal centers, and apparent kinetics study, the oxidation system employing porphyrin manganese(II) (T(2,3,6-triCl)PPMn) with bulkier substituents as catalyst, was regarded as the most promising and efficient one. For the typical substrate, the conversion of cumene could reach up to 57.6% with the selectivity of 70.5% toward alcohol, both of them being higher than the current documents under similar conditions. The superiority of T(2,3,6-triCl)PPMn was mainly attributed to its bulkier substituent groups preventing metalloporphyrins from oxidative degradation, its planar structure favoring the interaction between central metal with reactants, and the high efficiency of Mn(II) in the catalytic transformation of hydroperoxides to alcohols.

A 2 - hydroxy isopropyl substituted preparation method of acetophenone (by machine translation)

The invention relates to a method for synthesizing 2 - hydroxy isopropyl substituted acetophenone method, it includes S1: in the 130 - 140 °C temperature, will be acetyl benzoic acid methyl ester and ethylene glycol in the organic solvent and the presence of a catalyst under the conditions of the reaction, generating comprises intermediate reaction mixture 1st; S2: the 1st reaction mixture is cooled to room temperature, the reaction mixture purification 1st, get midbody; S3: in - 5 to 0 °C temperature, in an inert atmosphere environment, the intermediate of the tetrahydrofuran solution dripped into methyl bromide in tetrahydrofuran solution of the magnesium oxide, the method comprises generating the 2 - hydroxy isopropyl substituted acetophenone 2nd reaction mixture; and S4: purifying the 2nd reaction mixture, to obtain the 2 - hydroxy isopropyl substituted acetophenone; wherein said alkali comprises acyl benzoic acid methyl ester 4 - acetyl benzoic acid methyl ester or 3 - acetyl-benzoic acid methyl ester. The methods of the invention and is simple, preparation procedure is simple and convenient, high yield, small pollution to the environment. (by machine translation)

Ruthenium-Catalyzed C-H Hydroxylation in Aqueous Acid Enables Selective Functionalization of Amine Derivatives

The identification, optimization, and evaluation of a new catalytic protocol for sp3 C-H hydroxylation is described. Reactions are performed in aqueous acid using a bis(bipyridine)Ru catalyst to enable oxidation of substrates possessing basic amine functional groups. Tertiary and benzylic C-H hydroxylation is strongly favored over N-oxidation for numerous amine derivatives. With terpene-derived substrates, similar trends in reactivity toward tertiary and benzylic C-H bonds are observed. Hydroxylation of chiral tertiary centers is enantiospecific in spite of the ionizing strength of the reaction medium. Preliminary kinetics experiments show a marked difference in reactivity between isomeric cis- and trans-Ru catalysts suggesting that the catalyst is configurationally stable under the reaction conditions.

Effect of Substituents and Stability of Transient Aluminum-Aminals in the Presence of Nucleophiles

Disubstituted hydroxylamines are synthesized and used to form aluminum-amide complexes. These reagents mask carbonyl groups in situ via nucleophilic addition. The stability and utility of the aluminum-aminals are presented in the context of selectively controlling nucleophilic addition on substrates with multiple carbonyl groups.

SELECTIVE OCTAHYDRO-CYCLOPENTA[C] PYRROLE NEGATIVE MODULATORS OF NR2B

Compounds that selectively negatively modulate NMDA receptors containing an NR1/NR2B subunit, pharmaceutical compositions comprising the compounds, and methods of treating a disease using the compounds are disclosed. Such diseases include, without limitation, neurological dysfunction such as Parkinson's disease, Huntington's disease, amyotrophic lateral sclerosis, multiple sclerosis, and seizure disorders; emotional disorders; depression; bipolar disorder; obsessive-compulsive disorder; and other anxiety disorders.

Asymmetric hydrogenation of α,β-unsaturated nitriles with base-activated iridium N,P ligand complexes

Although many chiral catalysts are known that allow highly enantioselective hydrogenation of a wide range of olefins, no suitable catalysts for the asymmetric hydrogenation of α,β-unsaturated nitriles have been reported so far. We have found that Ir N,P ligand complexes, which under normal conditions do not show any reactivity towards α,β-unsaturated nitriles, become highly active catalysts upon addition of N,N- diisopropylethylamine. The base-activated catalysts enable conjugate reduction of α,β-unsaturated nitriles with H2 at low catalyst loadings, affording the corresponding saturated nitriles with high conversion and excellent enantioselectivity. In contrast, alkenes lacking a conjugated cyano group do not react under these conditions, making it possible to selectively reduce the conjugated C=C bond of an α,β-unsaturated nitrile, while leaving other types of C=C bonds in the molecule intact.