306935-39-7

Basic information

• Product Name: 1-(1,3-BENZODIOXOL-5-YL)-4,4,4-TRIFLUOROBUTANE-1,3-DIONE
• Synonyms: 3-[3,4-(METHYLENEDIXOY)BENZOYL]-1,1,1-TRIFLUOROACETONE;3-[3,4-(METHYLENEDIOXY)BENZOYL]-1,1,1-TRIFLUOROACETONE;1-(1,3-BENZODIOXOL-5-YL)-4,4,4-TRIFLUOROBUTANE-1,3-DIONE;1,3-Benzodioxol-5-yl-4,4,4-trifluorobutane-1,3-dione;1,3-Benzodioxol-5-yl-4,4,4-trifluorobutane-1,3-dione 97%;1,3-Benzodioxol-5-yl-4,4,4-trifluorobutane-1,3-dione97%;1-(1,3-Benzodioxol-5-yl)-2-trifluoroacetylethanone
• CAS NO: 306935-39-7
• Molecular Formula: C₁₁H₇F₃O₄
• Molecular Weight: 260.17
• Mol File: 306935-39-7.mol
• Article Data: 1

Chemical Properties

• Melting Point: 104-108
• Boiling Point: 339.9°Cat760mmHg
• Flash Point: 154.1°C
• Appearance: /
• Density: 1.456g/cm³
• Vapor Pressure: 8.91E-05mmHg at 25°C
• Refractive Index: 1.496
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• CAS DataBase Reference: 1-(1,3-BENZODIOXOL-5-YL)-4,4,4-TRIFLUOROBUTANE-1,3-DIONE(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(1,3-BENZODIOXOL-5-YL)-4,4,4-TRIFLUOROBUTANE-1,3-DIONE(306935-39-7)
• EPA Substance Registry System: 1-(1,3-BENZODIOXOL-5-YL)-4,4,4-TRIFLUOROBUTANE-1,3-DIONE(306935-39-7)

Safety Data

• Hazard Codes: Xi
• Hazardous Substances Data: 306935-39-7(Hazardous Substances Data)

Usage

General Description

1-(1,3-benzodioxol-5-yl)-4,4,4-trifluorobutane-1,3-dione is a chemical compound that contains a benzodioxole ring and a trifluorobutane-1,3-dione moiety. The benzodioxole ring is a fused six-membered ring system containing two oxygen atoms, while the trifluorobutane-1,3-dione moiety consists of a four-carbon chain with three fluorine atoms attached. 1-(1,3-BENZODIOXOL-5-YL)-4,4,4-TRIFLUOROBUTANE-1,3-DIONE is a synthetic organic compound and may have various applications such as in pharmaceutical research or as a building block for the synthesis of other organic compounds. Its chemical structure suggests potential for interaction with biological systems, and further research may be necessary to determine its specific properties and potential uses.

InChI:InChI=1/C11H7F3O4/c12-11(13,14)10(16)4-7(15)6-1-2-8-9(3-6)18-5-17-8/h1-3H,4-5H2

Upstream product

• 3162-29-6 1-(benzo[d][1,3]dioxol-6-yl)ethanone 
• 383-63-1 ethyl trifluoroacetate, 

Downstream Products

• 30418-53-2 1-(benzo[d][1,3]dioxol-5-yl)prop-2-en-1-one 

Relevant articles and documents

1,5-Diketones Synthesis via Three-Component Cascade Reaction

A mild and efficient cascade synthesis of 1,5-diketones from readily available N,N-dicyclohexylmethylamine, 1,3-dicarbonyl compounds, and trifluoromethyl β-diketones has been developed. This cascade reaction occurs via an oxidation/Mannich reaction/Cope elimination/Michael addition/retro-Claisen reaction sequence, and provides multiple C-C bond formations in one pot. In addition, exquisite chemoselectivity is achieved in the reaction between 1,3-dicarbonyl compounds and trifluoromethyl β-diketones.