50910-13-9

Basic information

• Product Name: (4-methylsulfanylphenyl) acetate
• CAS NO: 50910-13-9
• Molecular Formula: C₉H₁₀O₂S
• Molecular Weight: 182.243
• Mol File: 50910-13-9.mol
• Article Data: 7

Chemical Properties

• Boiling Point: 274.2°Cat760mmHg
• Flash Point: 125.4°C
• Density: 1.16g/cm³
• CAS DataBase Reference: (4-methylsulfanylphenyl) acetate(CAS DataBase Reference)
• NIST Chemistry Reference: (4-methylsulfanylphenyl) acetate(50910-13-9)
• EPA Substance Registry System: (4-methylsulfanylphenyl) acetate(50910-13-9)

Safety Data

• Hazardous Substances Data: 50910-13-9(Hazardous Substances Data)

Usage

General Description

(4-methylsulfanylphenyl) acetate is a chemical compound with the formula C10H12O2S. It is an ester, with a distinct fruity odor, often found in essential oils and fragrances. It is used as a flavoring agent in the food industry and as a fragrance ingredient in cosmetic and personal care products. (4-methylsulfanylphenyl) acetate can also be used as a reagent in organic synthesis to create other compounds. Overall, it plays a versatile role in various industries due to its pleasant aroma and chemical properties.

Upstream product

• 1073-72-9 4-hydroxythioanisole 
• 75-36-5 acetyl chloride 
• 947522-85-2 4-acetoxyphenyldimethylsulfonium triflate 
• 62262-76-4 carbonic acid ethyl ester-(4-mercapto-phenyl ester) 
• 637-89-8 4-sulfanylphenol 
• 108-24-7 acetic anhydride 

Downstream Products

• 480424-70-2 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl acetate 
• 114129-47-4 (S)-p-acetoxyphenyl methyl sulfoxide 
• 114129-46-3 (R)-p-acetoxyphenyl methyl sulfoxide 
• 114045-25-9 4-(methylsulfinyl)phenyl acetate 
• 67451-16-5 4-(methylsulfonyl)phenyl acetate 
• 14763-60-1 4-methanesulfonyl-phenol 

Relevant articles and documents

Iridium-Catalyzed ortho-C-H Borylation of Thioanisole Derivatives Using Bipyridine-Type Ligand

A simple iridium catalytic system was developed that allows for a variety of 2-borylthioanisoles to be easily synthesized via ortho-selective C-H borylation of thioanisole derivatives. Once introduced, boryl and methylthio groups were converted by palladium-catalyzed transformations. Density functional theory calculations revealed that weak interactions, such as hydrogen bonding between the C-H bond of the SCH3 group and the oxygen atom of the boryl ligand, control the ortho-selectivity.

Rhodium-Catalyzed ipso-Borylation of Alkylthioarenes via C-S Bond Cleavage

Rhodium-catalyzed transformation of alkyl aryl sulfides into arylboronic acid pinacol esters via C-S bond cleavage is reported. In combination with transition-metal-catalyzed sulfanyl group-guided regioselective C-H borylation reactions of alkylthioarenes, this method allows the synthesis of a diverse range of multisubstituted arenes.

Exploring the biocatalytic scope of a bacterial flavin-containing monooxygenase

A bacterial flavin-containing monooxygenase (FMO), fused to phosphite dehydrogenase, has been used to explore its biocatalytic potential. The bifunctional biocatalyst could be expressed in high amounts in Escherichia coli and was able to oxidize indole and indole derivatives into a variety of indigo compounds. The monooxygenase also performs the sulfoxidation of a wide range of prochiral sulfides, showing moderate to good enantioselectivities in forming chiral sulfoxides. The Royal Society of Chemistry 2011.