54549-72-3

Basic information

• Product Name: 1-[4-(2-hydroxypropan-2-yl)phenyl]ethanone
• Synonyms: 1-[4-(2-hydroxypropan-2-yl)phenyl]ethanone;4'-(1-Hydroxy-1-methylethyl)acetophenone
• CAS NO: 54549-72-3
• Molecular Formula: C₁₁H₁₄O₂
• Molecular Weight: 178.23
• Mol File: 54549-72-3.mol
• Article Data: 21

Chemical Properties

• Boiling Point: 308.4°C at 760 mmHg
• Flash Point: 130.4°C
• Appearance: /
• Density: 1.056g/cm³
• Vapor Pressure: 0.000295mmHg at 25°C
• Refractive Index: 1.523
• Storage Temp.: Refrigerator
• Solubility: Chloroform (Slightly), Methanol (Slightly)
• PKA: 14.07±0.29(Predicted)
• CAS DataBase Reference: 1-[4-(2-hydroxypropan-2-yl)phenyl]ethanone(CAS DataBase Reference)
• NIST Chemistry Reference: 1-[4-(2-hydroxypropan-2-yl)phenyl]ethanone(54549-72-3)
• EPA Substance Registry System: 1-[4-(2-hydroxypropan-2-yl)phenyl]ethanone(54549-72-3)

Safety Data

• Hazardous Substances Data: 54549-72-3(Hazardous Substances Data)

Usage

General Description

The chemical "1-[4-(2-hydroxypropan-2-yl)phenyl]ethanone" is an organic compound that is also known as "4'-isobutylacetophenone." It is a colorless to pale yellow liquid with a sweet floral odor. 1-[4-(2-hydroxypropan-2-yl)phenyl]ethanone is used as a fragrance ingredient in perfumes and other cosmetics. It is also used as an intermediate in the synthesis of pharmaceuticals and other organic compounds. Additionally, it has been studied for its potential as an anti-inflammatory and antioxidant agent. However, it is important to handle this chemical with care, as it may cause irritation to the skin, eyes, and respiratory system.

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 
• 107844-05-3 5-acetyl-3',3'-dimethylbicyclo<3.1.0>hex-3-ene-2-spiro-2'-oxirane 
• 583-05-1 1-phenylpentane-1,4-dione 
• 39575-67-2 (4-(2-methyl-1,3-dioxolan-2-yl)phenyl)magnesium bromide 
• 98-55-5 terpineol 
• 55873-39-7 4-isopropylidenecyclopentenyl methyl ketone 
• 101536-86-1 <4-(1-hydroperoxy-1-methylethyl)-1,3-cyclopentadien-1-yl>-1-ethanone 
• 107856-91-7 6a-acetyl-3,3a,4,6a-tetrahydro-2',2'-dimethyl-spiro 
• 5359-04-6 1-(4-(prop-1-en-2-yl)phenyl)ethan-1-one 
• 3609-53-8 methyl 4-acetylbenzoate 
• 75-16-1 methylmagnesium bromide 
• 917-54-4 methyllithium 
• 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 
• 110726-34-6 4,4'-(1-(4-(2-(4-hydroxy-3-methylphenyl)propan-2-yl)phenyl)ethane-1,1-diyl)bis(2-methylphenol) 
• 110726-28-8 4,4'-(1-(4 (2-(4-hydroxyphenyl)propane-2-yl)phenyl)ethane-1,1-diyl)bis(phenol) 

Relevant articles and documents

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.

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.

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.