163956-72-7

Basic information

• Product Name: 2-(4-(Methylsulfinyl)butyl)isoindoline-1,3-dione
• Synonyms: 2-(4-(Methylsulfinyl)butyl)isoindoline-1,3-dione
• CAS NO: 163956-72-7
• Molecular Formula: C₁₃H₁₅NO₃S
• Molecular Weight: 265.3281
• Mol File: 163956-72-7.mol
• Article Data: 3

Chemical Properties

• Boiling Point: 485.5°C at 760 mmHg
• Flash Point: 247.4°C
• Appearance: /
• Density: 1.332g/cm³
• Vapor Pressure: 1.41E-09mmHg at 25°C
• Refractive Index: 1.617
• CAS DataBase Reference: 2-(4-(Methylsulfinyl)butyl)isoindoline-1,3-dione(CAS DataBase Reference)
• NIST Chemistry Reference: 2-(4-(Methylsulfinyl)butyl)isoindoline-1,3-dione(163956-72-7)
• EPA Substance Registry System: 2-(4-(Methylsulfinyl)butyl)isoindoline-1,3-dione(163956-72-7)

Safety Data

• Hazardous Substances Data: 163956-72-7(Hazardous Substances Data)

Usage

General Description

"2-(4-(Methylsulfinyl)butyl)isoindoline-1,3-dione" is a chemical compound that belongs to the class of isoindoline-1,3-diones. It consists of a 2-(4-(Methylsulfinyl)butyl) substituent attached to the isoindoline-1,3-dione core. 2-(4-(Methylsulfinyl)butyl)isoindoline-1,3-dione is commonly used in the synthesis of pharmaceuticals and agrochemicals due to its versatile reactivity and ability to form various derivatives. Additionally, it possesses potential biological activities and has been studied for its therapeutic potential in various diseases. Furthermore, its unique chemical structure makes it a valuable tool in medicinal chemistry for the development of new drugs and bioactive compounds.

InChI:InChI=1/C13H15NO3S/c1-18(17)9-5-4-8-14-12(15)10-6-2-3-7-11(10)13(14)16/h2-3,6-7H,4-5,8-9H2,1H3

Upstream product

• 52096-68-1 2-<2-(Methylthio)butyl>-1H-isoindole-1,3(2H)-dione 
• 64-19-7 acetic acid 
• 5394-18-3 2-(4-bromobutyl)isoindoline-1,3-dione 
• 136918-14-4 phthalimide 

Downstream Products

• 84104-30-3 (+/-)-1-amino-4-(methylsulfinyl)butane 
• 550-44-7 N-methylphthalimide 
• 4478-93-7 D,L-sulforaphane 

Relevant articles and documents

Antioxidant activity of two edible isothiocyanates: Sulforaphane and erucin is due to their thermal decomposition to sulfenic acids and methylsulfinyl radicals

Sulforaphane (SFN) and erucin (ERN) are isothiocyanates (ITCs) bearing, respectively, methylsulfinyl and methylsulfanyl groups. Their chemopreventive and anticancer activity is attributed to ability to modulate cellular redox status due to induction of Phase 2 cytoprotective enzymes (indirect antioxidant action) but many attempts to connect the bioactivity of ITCs with their radical trapping activity failed. Both ITCs are evolved from their glucosinolates during food processing of Cruciferous vegetables, therefore, we studied antioxidant behaviour of SFN/ERN at elevated temperature in two lipid systems. Neither ERN nor SFN inhibit the oxidation of bulk linolenic acid (below 100 °C) but both ITCs increase oxidative stability of soy lecithin (above 150 °C). On the basis of GC-MS analysis we verified our preliminary hypothesis (Antioxidants 2020, 9, 1090) about participation of sulfenic acids and methylsulfinyl radicals as radical trapping agents responsible for the antioxidant effect of edible ITCs during thermal oxidation of lipids at elevated temperatures (above 140 °C).

Stabilized sulforaphane

A method of stabilizing sulforaphane is provided. The method includes contacting sulforaphane, or an analog thereof, and a cyclodextrin to form a complex between the sulforaphane, or analog thereof, and the cyclodextrin.