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243977-23-3

4-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID is a specialized chemical compound that belongs to the class of organic compounds known as phenylacetic acid derivatives. These are compounds containing a phenylacetic acid or its derivative, which is an aromatic compound with a structure that consists of a benzene ring substituted at the C2 carbon atom with acetic acid. This chemical often appears as a fine white crystalline powder and is primarily used in medicine and pharmaceuticals as a building block or intermediate for other chemical compounds. The presence of the trifluoromethylthio group can influence the reactivity of the compound, potentially enhancing its characteristics or properties in a specific application.

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  • 243977-23-3 Structure

  • Basic information

    1. Product Name: 4-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID
    2. Synonyms: RARECHEM AL BO 0862;4-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID;4-[(Trifluoromethyl)sulphanyl]phenylacetic acid;2-(4-(trifluoroMethylthio)phenyl)acetic acid;4-(Carboxymethyl)phenyl trifluoromethyl sulphide, {4-[(Trifluoromethyl)sulphanyl]phenyl}acetic acid;4-[(Trifluoromethyl)sulphanyl]phenylacetic acid 98%;4-(TrifluoroMethylthio)phenylaetic acid
    3. CAS NO:243977-23-3
    4. Molecular Formula: C9H7F3O2S
    5. Molecular Weight: 236.21
    6. EINECS: N/A
    7. Product Categories: Phenylacetic acid;Fluorine series
    8. Mol File: 243977-23-3.mol

  • Chemical Properties

    1. Melting Point: 114-118 °C(lit.)
    2. Boiling Point: 252.2 °C at 760 mmHg
    3. Flash Point: 106.3 °C
    4. Appearance: /Solid
    5. Density: 1.44 g/cm3
    6. Vapor Pressure: 0.0102mmHg at 25°C
    7. Refractive Index: 1.531
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. PKA: 4.05±0.10(Predicted)
    11. CAS DataBase Reference: 4-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID(CAS DataBase Reference)
    12. NIST Chemistry Reference: 4-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID(243977-23-3)
    13. EPA Substance Registry System: 4-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID(243977-23-3)

  • Safety Data

    1. Hazard Codes: Xi
    2. Statements: 36/37/38
    3. Safety Statements: 26-36
    4. WGK Germany: 3
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 243977-23-3(Hazardous Substances Data)

243977-23-3 Usage

Uses

Used in Pharmaceutical Industry:
4-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID is used as a building block or intermediate for the synthesis of other chemical compounds, particularly in the development of new pharmaceuticals. Its unique structure and the presence of the trifluoromethylthio group can contribute to the creation of novel drug candidates with improved therapeutic properties.
Used in Medicinal Chemistry Research:
4-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID is used as a research tool in medicinal chemistry to explore the effects of structural modifications on the biological activity of phenylacetic acid derivatives. This can lead to the discovery of new compounds with enhanced pharmacological properties, such as increased potency, selectivity, or reduced side effects.
Used in Drug Development:
4-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID is used as a starting material in the synthesis of potential drug candidates, allowing researchers to investigate the therapeutic potential of novel chemical entities. Its reactivity and the presence of the trifluoromethylthio group can be exploited to create new molecules with improved pharmacokinetic and pharmacodynamic profiles.

Check Digit Verification of cas no

The CAS Registry Mumber 243977-23-3 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,4,3,9,7 and 7 respectively; the second part has 2 digits, 2 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 243977-23:
(8*2)+(7*4)+(6*3)+(5*9)+(4*7)+(3*7)+(2*2)+(1*3)=163
163 % 10 = 3
So 243977-23-3 is a valid CAS Registry Number.
InChI:InChI=1/C9H7F3O2S/c10-9(11,12)15-7-3-1-6(2-4-7)5-8(13)14/h1-4H,5H2,(H,13,14)

243977-23-3 Well-known Company Product Price

  • Brand
  • (Code)Product description
  • CAS number
  • Packaging
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  • Alfa Aesar

  • (H63432)  4-(Trifluoromethylthio)phenylacetic acid, 98%   

  • 243977-23-3

  • 250mg

  • 196.0CNY

  • Detail

  • Alfa Aesar

  • (H63432)  4-(Trifluoromethylthio)phenylacetic acid, 98%   

  • 243977-23-3

  • 1g

  • 588.0CNY

  • Detail

  • Alfa Aesar

  • (H63432)  4-(Trifluoromethylthio)phenylacetic acid, 98%   

  • 243977-23-3

  • 5g

  • 2352.0CNY

  • Detail

243977-23-3SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-(TRIFLUOROMETHYLTHIO)PHENYLACETIC ACID

1.2 Other means of identification

Product number -
Other names RARECHEM AL BO 0862

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

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