93-77-6

Basic information

• Product Name: [(4-chloro-2,5-dimethylphenyl)thio]acetic acid
• Synonyms: [(4-chloro-2,5-dimethylphenyl)thio]acetic acid;2,5-dimethyl-4-chlorophenylmercaptoacetic acid;2-(4-chloro-2,5-dimethylphenyl)sulfanylacetic acid;2-(4-chloro-2,5-dimethyl-phenyl)sulfanylethanoic acid
• CAS NO: 93-77-6
• Molecular Formula: C₁₀H₁₁ClO₂S
• Molecular Weight: 230.71114
• EINECS: 202-274-9
• Mol File: 93-77-6.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 355.3°C at 760 mmHg
• Flash Point: 168.7°C
• Appearance: /
• Density: 1.31g/cm³
• Vapor Pressure: 1.15E-05mmHg at 25°C
• Refractive Index: 1.599
• Storage Temp.: 2-8°C
• CAS DataBase Reference: [(4-chloro-2,5-dimethylphenyl)thio]acetic acid(CAS DataBase Reference)
• NIST Chemistry Reference: [(4-chloro-2,5-dimethylphenyl)thio]acetic acid(93-77-6)
• EPA Substance Registry System: [(4-chloro-2,5-dimethylphenyl)thio]acetic acid(93-77-6)

Safety Data

• Hazardous Substances Data: 93-77-6(Hazardous Substances Data)

Usage

General Description

The chemical [(4-chloro-2,5-dimethylphenyl)thio]acetic acid is a compound that belongs to the class of thioacetic acids. It is characterized by a thio group (-SH) attached to an acetic acid backbone and a 4-chloro-2,5-dimethylphenyl group. [(4-chloro-2,5-dimethylphenyl)thio]acetic acid has applications in various fields, including pharmaceuticals and agrochemicals, where it can be used as a building block for the synthesis of complex molecules. Additionally, it may have potential therapeutic properties due to its thioacetic acid functionality. However, further research is needed to fully understand its biological and chemical properties.

InChI:InChI=1/C10H11ClO2S/c1-6-4-9(14-5-10(12)13)7(2)3-8(6)11/h3-4H,5H2,1-2H3,(H,12,13)

Upstream product

• 59962-29-7 4-Chloro-2,5-dimethylbenzenethiol 
• 19040-62-1 2,5-dimethylbenzenesulfonyl chloride 
• 95-78-3 2,5-Dimethylaniline 
• 95-72-7 2-chloro-1,4-dimethyl-benzene 
• 4001-61-0 2,5-dimethylthiophenol 
• 140-89-6 potassium ethyl xanthogenate 
• 79-11-8 chloroacetic acid 
• 3926-62-3 sodium monochloroacetic acid 
• 15310-87-9 (2,5-dimethyl-phenylsulfanyl)-acetic acid 
• 1147550-11-5 ammonium thiocyanate 

Relevant articles and documents

Propenoic acid derivatives

Compounds of formula I wherein X is CH or N; n is 0, 1, 2 or 3;, R1 and R3, which may be the same or different, are alkyl, alkoxy or alkylthio, each of which is optionally substituted, halogen, nitro, cyano, COOR4, -NR5R6, CONR5R6, COR7 or R8S(O)q; or R1 and an adjacent R3 group, or two adjacent R3 groups, together with the carbon atoms to which they are attached can form a 5 to 8 membered ring which can include 1 to 3 heteroatoms and may be substituted;, R2 is an optionally substituted aliphatic hydrocarbon radical, which may be unsaturated, aryl or heterocyclyl;, R4 is hydrogen or an ester forming group;, R5 and R6 are the same or different and are hydrogen, optionally substituted alkyl, acyl or aryl, or together with the nitrogen to which they are attached, form a 5 to 7 membered ring which can contain other hetero atoms;, R7 is hydrogen, optionally substituted alkyl or aryl;, R8 is optionally substituted alkyl or aryl; and, q is 1 or 2, have fungicidal activity as do the intermediates of formula II wherein R9 is hydrogen or methyl, and of formula III