5435-66-5

Basic information

• Product Name: 1-(3-NITRO-PHENYL)-BUTANE-1,3-DIONE
• Synonyms: (m-nitrobenzoyl)acetone;1-(3-nitrophenyl)-3-butanedione;1-(m-nitrophenyl)-3-butanedione;1-(3-NITRO-PHENYL)-BUTANE-1,3-DIONE;1-(3-Nitrophenyl)-1,3-butanedione
• CAS NO: 5435-66-5
• Molecular Formula: C₁₀H₉NO₄
• Molecular Weight: 207.18
• Mol File: 5435-66-5.mol
• Article Data: 3

Chemical Properties

• Boiling Point: 311°Cat760mmHg
• Flash Point: 141.5°C
• Appearance: /
• Density: 1.271g/cm³
• Vapor Pressure: 0.00058mmHg at 25°C
• Refractive Index: 1.552
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• CAS DataBase Reference: 1-(3-NITRO-PHENYL)-BUTANE-1,3-DIONE(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(3-NITRO-PHENYL)-BUTANE-1,3-DIONE(5435-66-5)
• EPA Substance Registry System: 1-(3-NITRO-PHENYL)-BUTANE-1,3-DIONE(5435-66-5)

Safety Data

• Hazardous Substances Data: 5435-66-5(Hazardous Substances Data)

Usage

General Description

1-(3-Nitro-phenyl)-butane-1,3-dione is a chemical compound with the molecular formula C10H11NO4. It is a yellow to orange crystalline powder that is used in the synthesis of organic compounds and in research laboratories. 1-(3-NITRO-PHENYL)-BUTANE-1,3-DIONE is also known as 3-Nitro-acetylacetone and is commonly used in the production of pharmaceuticals and other fine chemicals. It is important to handle this compound with caution as it is a potential irritant to the skin, eyes, and respiratory system.

InChI:InChI=1/C10H9NO4/c1-7(12)5-10(13)8-3-2-4-9(6-8)11(14)15/h2-4,6H,5H2,1H3

Upstream product

• 108-24-7 acetic anhydride 
• 121-89-1 3-Nitroacetophenone 
• 93-91-4 1-phenylbutan-1,3-dione 
• 7664-93-9 sulfuric acid 
• 93257-82-0 ethyl-2-(3-nitrobenzoyl)-3-oxobutanoate 
• 67-64-1 acetone 
• 645-00-1 m-iodonitrobenzene 

Downstream Products

• 137831-57-3 3-methyl-5-(3-nitro-phenyl)-1⁽²⁾H-pyrazole 
• 87339-08-0 1-(3-amino-phenyl)-butane-1,3-dione 
• 108718-60-1 3-methyl-5-(3-nitro-phenyl)-1-phenyl-1H-pyrazole 
• 95346-62-6 C₁₆H₁₁N₄O₁₀^(1-) 
• 118431-56-4 3-cyclopentyl-1,6-dimethyl-4-(3-nitrophenyl)pyrazolo<3,4-b>pyridine 
• 343957-23-3 4-Bromo-1-(3-nitro-phenyl)-butane-1,3-dione 
• 82366-10-7 Benzoic acid N'-[(Z)-1-methyl-3-(3-nitro-phenyl)-3-oxo-propenyl]-hydrazide 
• 134599-99-8 4-(m-nitrophenyl)-6-methyl-3-cyano-2-pyridone 
• 134599-98-7 6-(m-nitrophenyl)-4-methyl-3-cyano-2-pyridone 
• 189306-87-4 5-Methyl-4-(3-nitro-benzoyl)-isoxazole-3-carboxylic acid ethyl ester 
• 189306-89-6 3-Methyl-4-(3-nitro-phenyl)-6H-isoxazolo[3,4-d]pyridazin-7-one 
• 189306-92-1 6-Ethyl-3-methyl-4-(3-nitro-phenyl)-6H-isoxazolo[3,4-d]pyridazin-7-one 
• 189306-96-5 5-Acetyl-2-ethyl-4-nitro-6-(3-nitro-phenyl)-2H-pyridazin-3-one 
• 107504-82-5 2-[5,6-Dihydro-imidazo[2,1-b]thiazol-(3E)-ylidene]-1-(3-nitro-phenyl)-ethanone 

Relevant articles and documents

Synthesis of Highly Substituted Biaryls by the Construction of a Benzene Ring via in Situ Formed Acetals

Herein, we present an interesting method for the construction of a benzene ring using propargylic alcohols and 1,3-dicarbonyls, which involves three new C-C bond formations via cascade alkylation, formylation, annulation, and aromatization to make substituted biaryls. This one-pot Br?nsted acid-promoted protocol utilizes the unique reactivity of the acetal formed under the reaction conditions. Alkynyl methyl ketones could be employed instead of 1,3-dicarbonyls as they are converted to 1,3-dicarbonyls by hydration under the reaction conditions.

O -Iodoxybenzoic Acid (IBX)-Iodine Mediated One-Pot Deacylative Sulfonylation of 1,3-Dicarbonyl Compounds: A Synthesis of β-Carbonyl Sulfones

A combination of o-iodoxybenzoic acid (IBX) and a catalytic amount of iodine is found to promote a facile one-pot deacylative sulfonylation reaction of 1,3-dicarbonyl compounds with sodium sulfinates to yield β-carbonyl sulfones. The present method provides the target products bearing a wide variety of functional groups in one step and in good yields.