13334-00-4

Basic information

• Product Name: (2-TRIFLUOROMETHYL-PHENYLTHIO)-ACETIC ACID
• Synonyms: (2-TRIFLUOROMETHYL-PHENYLTHIO)-ACETIC ACID;2-Trifluorophenylthioaceticacid;2-Trifluoro phenyl t
• CAS NO: 13334-00-4
• Molecular Formula: C₉H₇F₃O₂S
• Molecular Weight: 220.21
• Mol File: 13334-00-4.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 307.6 °C at 760 mmHg
• Flash Point: 139.8 °C
• Appearance: /
• Density: 1.44 g/cm³
• Refractive Index: 1.511
• PKA: 3.32±0.10(Predicted)
• CAS DataBase Reference: (2-TRIFLUOROMETHYL-PHENYLTHIO)-ACETIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: (2-TRIFLUOROMETHYL-PHENYLTHIO)-ACETIC ACID(13334-00-4)
• EPA Substance Registry System: (2-TRIFLUOROMETHYL-PHENYLTHIO)-ACETIC ACID(13334-00-4)

Safety Data

• Hazardous Substances Data: 13334-00-4(Hazardous Substances Data)

Usage

Description

(2-TRIFLUOROMETHYL-PHENYLTHIO)-ACETIC ACID, with the molecular formula C9H7F3O2S, is a chemical compound derived from acetic acid, featuring a trifluoromethyl-phenylthio group. This unique structure endows it with potential biological and therapeutic properties, making it a valuable building block in organic synthesis and pharmaceutical research.

Uses

Used in Pharmaceutical Research:
(2-TRIFLUOROMETHYL-PHENYLTHIO)-ACETIC ACID is used as a building block in the development of novel drug candidates due to its unique structure and potential pharmacological activities.
Used in Organic Synthesis:
(2-TRIFLUOROMETHYL-PHENYLTHIO)-ACETIC ACID is utilized as a key intermediate in the synthesis of various organic compounds, contributing to the advancement of chemical research and the creation of new materials.
Used in Anti-inflammatory and Analgesic Applications:
(2-TRIFLUOROMETHYL-PHENYLTHIO)-ACETIC ACID is studied for its potential as an anti-inflammatory and analgesic agent, offering a promising avenue for the development of new treatments for pain and inflammation-related conditions.

InChI:InChI=1/C8H5F3OS/c9-8(10,11)7(13)12-6-4-2-1-3-5-6/h1-5H

Upstream product

• 88-16-4 1-chloro-2-(trifluoromethyl)benzene 
• 124-38-9 carbon dioxide 
• 322-58-7 2-(methylthio)-1-(trifluoromethyl)benzene 

Relevant articles and documents

Propenyl cephalosporin derivatives and process for the manufacture thereof

Disclosed are cephalosporin derivatives of the general formula wherein R is an organic residue with a molecular weight not exceeding 400 bonded to the adjacent sulphur atom via carbon and consisting of carbon, hydrogen, and optional oxygen, sulfur, nitrogen and/or halogen atoms; R1 is hydrogen, lower alkyl or phenyl; and A is a secondary, tertiary or quaternary nitrogen atom bound directly to the propenyl group and being substituted by an organic residue with a molecular weight not exceeding 400 and consisting of carbon, hydrogen, and optional oxygen, sulfur, nitrogen and/or halogen atoms,as well as readily hydrolyzable esters thereof, pharmaceutically acceptable salts of said compounds and hydrates of the compounds of formula I and of their esters and salts.