5332-96-7

Basic information

• Product Name: 4-NITROPHENYLACETONE
• Synonyms: 1-(4-Nitrophenyl)acetone;2-Propanone, 1-(4-nitrophenyl)-;(P-NITROPHENYL)ACETONE;4-NITROPHENYLACETONE;1-(4-Nitrophenyl)-2-propanone;4-Nitrophenylacetone,98%;1-(2-Oxopropyl)-4-nitrobenzene;1-(p-Nitrophenyl)-2-propanone
• CAS NO: 5332-96-7
• Molecular Formula: C₉H₉NO₃
• Molecular Weight: 179.17
• Product Categories: Aromatic Ketones (substituted)
• Mol File: 5332-96-7.mol
• Article Data: 44

Chemical Properties

• Melting Point: 63-64°C
• Boiling Point: 307.5°Cat760mmHg
• Flash Point: 146.4°C
• Appearance: /
• Density: 1.212g/cm³
• Vapor Pressure: 0.000724mmHg at 25°C
• Refractive Index: 1.549
• Storage Temp.: Sealed in dry,Room Temperature
• Water Solubility: Insoluble in water, soluble in usual organic solvents.
• BRN: 1953054
• CAS DataBase Reference: 4-NITROPHENYLACETONE(CAS DataBase Reference)
• NIST Chemistry Reference: 4-NITROPHENYLACETONE(5332-96-7)
• EPA Substance Registry System: 4-NITROPHENYLACETONE(5332-96-7)

Safety Data

• Statements: 36/37/38
• Safety Statements: 23-36/37/39
• Hazardous Substances Data: 5332-96-7(Hazardous Substances Data)

Usage

Uses

It is applied as an intermediate in organic synthesis.

InChI:InChI=1/C9H9NO3/c1-7(11)6-8-2-4-9(5-3-8)10(12)13/h2-5H,6H2,1H3

Upstream product

• 98-95-3 nitrobenzene 
• 67-64-1 acetone 
• 108-59-8 malonic acid dimethyl ester 
• 50434-36-1 4-nitrophenylacetyl chloride 
• 105-53-3 diethyl malonate 
• 7697-37-2 nitric acid 
• 103-79-7 1-phenyl-acetone 
• 636-98-6 p-nitrobenzene iodide 
• 123-54-6 acetylacetone 
• 108-22-5 Isopropenyl acetate 
• 100-01-6 4-nitro-aniline 
• 123-42-2 4-Hydroxy-4-methyl-2-pentanone 
• 586-78-7 para-nitrophenyl bromide 
• 100-00-5 4-chlorobenzonitrile 

Downstream Products

• 860519-10-4 2-chloro-1-(4-nitro-phenyl)-propene 
• 431946-43-9 (+/-)1-[1-methyl-2-(4-nitrophenyl)ethyl]-4-phenylpiperazine 
• 868363-14-8 2-{[(Z)-1-Methyl-2-(4-nitro-phenyl)-vinylamino]-methylene}-malonic acid diethyl ester 
• 4302-88-9 p-nitromethamphetamine 
• 943961-64-6 N-benzyl-N-[1-(4-nitrophenyl)-2-propyl]amine 
• 15582-94-2 3-methyl-3-(4-nitro-phenyl)-butan-2-one 
• 1099794-22-5 2-[1-methyl-3-(4-nitrophenyl)-4-oxo-2-pentenylidene]-1-hydrazinecarboxamide 
• 1350815-10-9 (5R,6R)-6-(4-nitrophenyl)-5-propylcyclohex-2-enone 
• 1350815-12-1 (5S,6R)-5-isopropyl-6-(4-nitrophenyl)cyclohex-2-enone 
• 1350815-11-0 (5R,6R)-5-butyl-6-(4-nitrophenyl)cyclohex-2-enone 
• 1350815-16-5 (5R,6R)-5-(4-nitrophenyl)-6-(4-nitrophenyl)cyclohex-2-enone 
• 1350815-09-6 (5R,6R)-5-ethyl-6-(4-nitrophenyl)cyclohex-2-enone 

Relevant articles and documents

Asymmetric Catalytic Epoxidation of Terminal Enones for the Synthesis of Triazole Antifungal Agents

An enantioselective epoxidation of α-substituted vinyl ketones was realized to construct the key epoxide intermediates for the synthesis of various triazole antifungal agents. The reaction proceeded efficiently in high yields with good enantioselectivities by employing a chiral N,N′-dioxide/ScIII complex as the chiral catalyst and 35% aq. H2O2 as the oxidant. It enabled the facile transformation for optically active isavuconazole, efinaconazole, and other potential antifungal agents.

Aryl C-F bond functionalization preparation method

The invention relates to the technical field of organic compound synthesis, in particular to an aryl C-F bond functionalization preparation method. A fluorobenzene compound and a nucleophilic reagent react under the action of a composite catalyst, wherein the composite catalyst is formed by mixing a visible light catalyst and a metal catalyst. The photocatalyst is adopted, the reaction process is safe and controllable, and operation in the preparation and production process is simplified; a purple LED is used as a reaction energy source and is green and environment-friendly, the energy utilization rate is high, and conversion from light energy to chemical energy can be efficiently realized; in the reaction, a simple nucleophilic reagent is used for attacking free radical cation species generated under a visible light catalysis condition, so that a target product with an extremely wide range is efficiently and greenly prepared; the operation steps are simplified, and the reaction route is shortened; and moreover, the forward reaction rate is high, and the production efficiency is remarkably improved.

Preparation method of Rugolix key intermediate

The invention relates to a preparation method of a Rugolix key intermediate. 4-nitrophenyl acetic acid is used as a raw material, and a target product is obtained through four steps of reaction. The preparation method avoids the use of toxic reagents and has the advantages of mild reaction conditions, low cost, high yield and simple route and is suitable for industrial large-scale production.