51227-29-3

Basic information

• Product Name: 2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE
• Synonyms: 2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE;2-methyl-1-(3-pyridinyl)-1-propanone(SALTDATA: FREE);2-METHYL-1-(PYRIDIN-3-YL)PROPAN-1-ONE
• CAS NO: 51227-29-3
• Molecular Formula: C₉H₁₁NO
• Molecular Weight: 149.19
• Mol File: 51227-29-3.mol
• Article Data: 19

Chemical Properties

• Boiling Point: 245.743°C at 760 mmHg
• Flash Point: 108.705°C
• Appearance: /
• Density: 1.011g/cm³
• Vapor Pressure: 0.028mmHg at 25°C
• Refractive Index: 1.503
• PKA: 2.96±0.11(Predicted)
• CAS DataBase Reference: 2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE(51227-29-3)
• EPA Substance Registry System: 2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE(51227-29-3)

Safety Data

• Hazardous Substances Data: 51227-29-3(Hazardous Substances Data)

Usage

Description

2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE is a chemical compound with the molecular formula C9H11NO. It is a yellow liquid with a distinct odor and is commonly used as an intermediate in the production of pharmaceuticals, agrochemicals, and other organic compounds. Known for its versatile reactivity, it is often used as a building block in organic synthesis.

Uses

Used in Pharmaceutical Industry:
2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE is used as an intermediate for the production of various pharmaceuticals, contributing to the development of new drugs and medications.
Used in Agrochemical Industry:
2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE is also used as an intermediate in the production of agrochemicals, playing a role in the development of pesticides and other agricultural products.
Used in Organic Synthesis:
2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE is utilized as a building block in organic synthesis, enabling the creation of a wide range of organic compounds for various applications.
Used in Food and Beverage Industry:
As a flavoring and fragrance agent, 2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE is used to enhance the taste and aroma of food and beverage products.
Used in Insect Repellent Production:
2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE is used in the production of insect repellents, helping to create products that protect against insect bites and diseases.
Used in Household and Personal Care Products:
2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE can be found in some household and personal care products, contributing to their effectiveness and functionality.
It is important to handle 2-METHYL-1-(3-PYRIDINYL)-1-PROPANONE with caution, as it can cause irritation to the skin, eyes, and respiratory system if not used properly.

InChI:InChI=1/C9H11NO/c1-7(2)9(11)8-4-3-5-10-6-8/h3-7H,1-2H3

Upstream product

• 626-55-1 3-Bromopyridine 
• 79-30-1 isobutyryl chloride 
• 500-22-1 3-pyridinecarboxaldehyde 
• 3900-79-6 toluene-4-sulfonic acid isopropylidenehydrazide 
• 67-56-1 methanol 
• 144825-44-5 (+/-)-tert-butyl 1-(pyridin-3'-yl)prop-2-en-1-yl carbonate 
• 1570-48-5 1-(pyridin-3-yl)propan-1-one 
• 350-03-8 methyl-3-pyridylketone 
• 102994-45-6 2-methyl-1-(pyridin-3-yl)propan-1-ol 
• 4621-66-3 thionicotinamide 
• 563-79-1 2,3-Dimethyl-2-butene 
• 74-88-4 methyl iodide 
• 1122-54-9 methyl (4-pyridyl) ketone 
• 100-54-9 pyridine-3-carbonitrile 

Downstream Products

• 142874-53-1 1-(2-Methoxy-3,4,6-trimethylphenyl)-1-(pyridin-3-yl)-2-methylpropanol 
• 54-36-4 metyrapone 
• 1361052-23-4 C₁₅H₁₀F₅NO 
• 1069130-27-3 C₁₇H₁₅NO 
• 102994-45-6 2-methyl-1-(pyridin-3-yl)propan-1-ol 

Relevant articles and documents

Harnessing the Role of HDAC6 in Idiopathic Pulmonary Fibrosis: Design, Synthesis, Structural Analysis, and Biological Evaluation of Potent Inhibitors

Idiopathic pulmonary fibrosis (IPF) is an interstitial lung disease characterized by a progressive-fibrosing phenotype. IPF has been associated with aberrant HDAC activities confirmed by our immunohistochemistry studies on HDAC6 overexpression in IPF lung tissues. We herein developed a series of novelhHDAC6 inhibitors, having low inhibitory potency overhHDAC1 andhHDAC8, as potential pharmacological tools for IPF treatment. Their inhibitory potency was combined with lowin vitroandin vivotoxicity. Structural analysis of 6h and structure-activity relationship studies contributed to the optimization of the binding mode of the new molecules. The best-performing analogues were tested for their efficacy in inhibiting fibrotic sphere formation and cell viability, proving their capability in reverting the IPF phenotype. The efficacy of analogue 6h was also determined in a validated human lung model of TGF-β1-dependent fibrogenesis. The results highlighted in this manuscript may pave the way for the identification of first-in-class molecules for the treatment of IPF.

One-Pot Conversion of Allylic Alcohols to α-Methyl Ketones via Iron-Catalyzed Isomerization-Methylation

A one-pot iron-catalyzed conversion of allylic alcohols to α-methyl ketones has been developed. This isomerization-methylation strategy utilized a (cyclopentadienone)iron(0) carbonyl complex as precatalyst and methanol as the C1 source. A diverse range of allylic alcohols undergoes isomerization-methylation to form α-methyl ketones in good isolated yields (up to 84% isolated yield).

Iron-Catalyzed Methylation Using the Borrowing Hydrogen Approach

A general iron-catalyzed methylation has been developed using methanol as a C1 building block. This borrowing hydrogen approach employs a Kn?lker-type (cyclopentadienone)iron carbonyl complex as catalyst (2 mol %) and exhibits a broad reaction scope. A variety of ketones, indoles, oxindoles, amines, and sulfonamides undergo mono- or dimethylation in excellent isolated yields (>60 examples, 79% average yield).