40096-23-9

Basic information

• Product Name: 3-FLUOROTHIOANISOLE
• Synonyms: 3-Fluorobenzenemethanethiol;3-Fluorobenzylmercaptan;m-Fluorobenzyl mercaptan
• CAS NO: 40096-23-9
• Molecular Formula: C₇H₇FS
• Molecular Weight: 142.2
• Product Categories: Sulfur
• Mol File: 40096-23-9.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 177.5 °C at 760 mmHg
• Flash Point: 61.2 °C
• Appearance: /
• Density: 1.13 g/cm³
• Vapor Pressure: 1.39mmHg at 25°C
• Refractive Index: 1.544
• PKA: 9.34±0.10(Predicted)
• CAS DataBase Reference: 3-FLUOROTHIOANISOLE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-FLUOROTHIOANISOLE(40096-23-9)
• EPA Substance Registry System: 3-FLUOROTHIOANISOLE(40096-23-9)

Safety Data

• Hazard Codes: Xi
• HazardClass: IRRITANT, STENCH
• Hazardous Substances Data: 40096-23-9(Hazardous Substances Data)

Usage

General Description

3-Fluorothioanisole is a chemical compound with the formula C7H7FS. It is a colorless liquid with a pungent odor, and is commonly used as a building block in organic synthesis. It is known for its use as a reagent in various chemical reactions, including nucleophilic aromatic substitutions and as a precursor to other fluorinated compounds. Its unique properties make it a valuable tool in the pharmaceutical and agrochemical industries for the synthesis of diverse organic molecules. Additionally, 3-fluorothioanisole has applications in the production of fragrances and flavoring agents, making it a versatile and widely used chemical compound.

InChI:InChI=1/C7H7FS/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H3

Upstream product

• 456-42-8 m-fluorobenzyl chloride 
• 456-47-3 3-fluoro-benzenemethanol 
• 775263-49-5 2-(3-Fluoro-benzyl)-isothiourea 

Downstream Products

• 63875-88-7 3-Fluorbenzyl-2-hydroxyethyldisulfid 
• 75663-55-7 4-(2-fluorophenyl)-1,2,3,6-tetrahydro-1-methylpyridine 
• 72364-83-1 base 4-(3-fluorobenzylthio)-4-(2-fluorophenyl)-1-methylpiperidine 
• 456-48-4 3-Fluorobenzaldehyde 
• 1346518-02-2 methyl 2-[1-(3-fluorobenzylsulfonyl)-2-methylindolizin-3-yl]acetate 
• 1346518-00-0 methyl 2-[1-(3-fluorobenzylsulfonyl)-2-methylindolizin-3-yl]-2-hydroxyacetate 
• 1346517-98-3 methyl 2-[1-(3-fluorobenzylsulfonyl)-2-methylindolizin-3-yl]-2-oxoacetate 
• 1346517-96-1 1-(3-fluorobenzylsulfonyl)-2-methylindolizine 
• 1346517-94-9 2-(3-fluorobenzylsulfonylmethyl)pyridine 
• 1346517-78-9 1-(3-fluorobenzylsulfonyl)-2-methylindolizin-3-yl-N-(3-chlorobenzyl)-N-methylacetamide 
• 1346518-04-4 [1-(3-fluorobenzylsulfonyl)-2-methylindolizin-3-yl]acetic acid 
• 1346517-92-7 2-(3-fluorobenzylthiomethyl)pyridine 
• 1313039-64-3 3-(3-fluorobenzylthio)-5-methyl[1,2,4]triazine 
• 72364-82-0 salt of 4-(3-fluorobenzylthio)-4-(2-fluorophenyl)-1-methylpiperidine hydrobromide 

Relevant articles and documents

Synthesis and Biological Activity of trans-(+/-)-N-Methyl-2-(3-pirydyl)-2-tetrahydrothiopyrancarbothioamide 1-Oxide (RP 49356) and Analogues: A New Class of Potassium Channel Opener

The synthesis and biological activity of trans-(+/-)-N-methyl-2-(3-pyridyl)-2-tetrahydrothiopyrancarbothioamide 1-oxide (8a, RP 49356) and analoques is reported.These compounds constitute a new structural class of K+-channel opener.The effects of changes in the pyridyl group, thioamide, and thiane ring on in vitro K+-channel opening activity are discussed.A 3-pyridyl or 3-quinolyl group, a small N-alkyl thioamide function, and a thiane oxide ring, in which the sulfoxide is in a trans relationship to thioamide, are preferred for activity.Selected compounds were tested intravenously in the normotensive anaesthetized rat for hypotensive effects, and the activities reflect their in vitro K+-channel opening activity.This led to further evaluation of compound 8a and the selection of the (-)-enantiomer 8b (RP 52891) for development as an antihypertensive and antianginal agent.