72424-08-9

Basic information

• Product Name: 3-propylisobenzofuran-1(3H)-one
• Synonyms: 3-propylisobenzofuran-1(3H)-one;3-propyl-3H-2-benzofuran-1-one
• CAS NO: 72424-08-9
• Molecular Formula: C₁₁H₁₂O₂
• Molecular Weight: 176.21178
• EINECS: -0
• Mol File: 72424-08-9.mol
• Article Data: 17

Chemical Properties

• Boiling Point: 116 °C(Press: 1 Torr)
• Appearance: /
• Density: 1.100±0.06 g/cm3(Predicted)
• CAS DataBase Reference: 3-propylisobenzofuran-1(3H)-one(CAS DataBase Reference)
• NIST Chemistry Reference: 3-propylisobenzofuran-1(3H)-one(72424-08-9)
• EPA Substance Registry System: 3-propylisobenzofuran-1(3H)-one(72424-08-9)

Safety Data

• Hazardous Substances Data: 72424-08-9(Hazardous Substances Data)

Usage

General Description

3-propylisobenzofuran-1(3H)-one is a chemical compound with the molecular formula C12H14O. It belongs to the class of organic compounds known as benzofurans, which are heterocyclic compounds containing a furan ring fused to a benzene ring. This chemical is characterized by a propyl side chain attached to the furan ring. 3-propylisobenzofuran-1(3H)-one has been identified as a flavoring agent, and it is commonly used in the fragrance and flavor industry. It is known for its sweet, floral, and herbal aroma and is used in various consumer products such as perfumes, cosmetics, and food flavorings. Additionally, this compound has been researched for its potential medicinal and therapeutic properties, including anti-inflammatory and antioxidant effects.

Upstream product

• 16859-59-9 3-hydroxy-1(3H)-isobenzofuranone 
• 106-94-5 propyl bromide 
• 54887-23-9 2-butylbenzoic acid 
• 27326-43-8 2-vinylbenzoic acid 
• 1696-17-9 N,N-diethylbenzamide 
• 123-72-8 butyraldehyde 
• 17369-59-4 3-(n-propylidene)phthalide 
• 85-44-9 phthalic anhydride 
• 107-08-4 1-iodo-propane 
• 855472-09-2 2-butyryl-benzoic acid ethyl ester 
• 1829-28-3 ethyl 2-iodobenzoate 
• 201230-82-2 carbon monoxide 
• 56221-45-5 methyl 2-butyrylbenzoate 
• 19666-03-6 butyrophenone-o-carboxylic acid 

Downstream Products

• 117436-86-9 α-propyl benzenedimethanol-1,2 
• 952412-99-6 C₁₁H₁₄O₃ 
• 117436-87-0 (bromo-1 butyl)-1 bromomethyl-2 benzene 
• 65-85-0 benzoic acid 
• 107-92-6 butyric acid 

Relevant articles and documents

Visible Light-Promoted Magnesium, Iron, and Nickel Catalysis Enabling C(sp3)-H Lactonization of 2-Alkylbenzoic Acids

A mild and practical C(sp3)-H lactonization protocol has been achieved by merging photocatalysis and magnesium (iron, nickel) catalysis. A diverse range of 2-alkylbenzoic acids with a variety of substitution patterns could be transformed into the corresponding phthalide products. Based on the mechanistic experimentation and reported prior studies, a possible mechanism for the benzylic oxidative lactonization reaction was proposed with the hypothetic photoactive ternary complex formed between the 2-alkylbenzoic acid substrate, magnesium ion, and bromate anion.

Saturated oxygen and nitrogen heterocycles: Via oxidative coupling of alkyltrifluoroborates with alkenols, alkenoic acids and protected alkenylamines

Saturated heterocycles are important components of many bioactive compounds. The method disclosed herein enables a general route to a range of 5-, 6- and 7-membered oxygen and nitrogen heterocycles by coupling potassium alkyltrifluoroborates with heteroat

Electron-Transfer-Induced Intramolecular Heck Carbonylation Reactions Leading to Benzolactones and Benzolactams

A metal-catalyst-free intramolecular Heck carbonylation reaction of benzyl alcohols and benzyl amines with carbon monoxide under heating at 250 °C affords the corresponding benzolactones and benzolactams in good to excellent yields. A hybrid radical/ionic chain mechanism, involving electron transfer from radical anions generated by nucleophilic attack of alcohols or amines on intermediate acyl radicals, is proposed.