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CAS

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827-20-3

5-Fluoro-2-(trifluoromethyl)aniline, with the chemical formula C8H5F4N, is an organofluorine compound that belongs to the class of organic compounds containing fluorine. The presence of fluorine in its structure suggests potential applications in the pharmaceutical industry, as fluorine is known to enhance the bioactivity of drugs. Additionally, the "aniline" component of the molecule indicates that it may be utilized in the production of dyes, drugs, and plastics. Further research would be necessary to understand its physical properties, toxicity, bioactivity, environmental impact, and health effects.

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  • 827-20-3 Structure

  • Basic information

    1. Product Name: 5-FLUORO-2-(TRIFLUOROMETHYL)ANILINE
    2. Synonyms: 2-AMINO-4-FLUOROBENZOTRIFLUORIDE;5-FLUORO-2-(TRIFLUOROMETHYL)ANILINE;2-AMino-4-fluorobenzotrifluoride[5-Fluoro-2-(trifluoroMethyl)aniline];5-Fluoro-2-(trifluoromethyl)benzenamine;5-Fluoro-2-(trifluoromethyl)aniline[2-Amino-4-fluorobenzotrifluoride]
    3. CAS NO:827-20-3
    4. Molecular Formula: C7H5F4N
    5. Molecular Weight: 179.11
    6. EINECS: N/A
    7. Product Categories: Aniline
    8. Mol File: 827-20-3.mol

  • Chemical Properties

    1. Melting Point: 29-32℃
    2. Boiling Point: 185.6 °C at 760 mmHg
    3. Flash Point: 74.4°C
    4. Appearance: /
    5. Density: 1.383 g/cm3
    6. Vapor Pressure: 0.692mmHg at 25°C
    7. Refractive Index: 1.46
    8. Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
    9. Solubility: N/A
    10. PKA: 0.45±0.10(Predicted)
    11. Water Solubility: Insoluble in water.
    12. CAS DataBase Reference: 5-FLUORO-2-(TRIFLUOROMETHYL)ANILINE(CAS DataBase Reference)
    13. NIST Chemistry Reference: 5-FLUORO-2-(TRIFLUOROMETHYL)ANILINE(827-20-3)
    14. EPA Substance Registry System: 5-FLUORO-2-(TRIFLUOROMETHYL)ANILINE(827-20-3)

  • Safety Data

    1. Hazard Codes: T
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: 6.1
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 827-20-3(Hazardous Substances Data)

827-20-3 Usage

Uses

Used in Pharmaceutical Industry:
5-Fluoro-2-(trifluoromethyl)aniline is used as a chemical intermediate for the synthesis of various pharmaceutical compounds, leveraging the bioactivity-enhancing properties of fluorine. This can lead to the development of more effective drugs with improved pharmacokinetic and pharmacodynamic profiles.
Used in Dye Manufacturing:
5-Fluoro-2-(trifluoromethyl)aniline is used as a key component in the production of dyes, where the presence of fluorine and the aniline group contribute to the color and stability of the dyes.
Used in Plastics Industry:
5-Fluoro-2-(trifluoromethyl)aniline is used as a monomer or a building block in the synthesis of certain types of plastics, where its unique chemical structure can impart specific properties to the final plastic products, such as improved durability or chemical resistance.

Check Digit Verification of cas no

The CAS Registry Mumber 827-20-3 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 8,2 and 7 respectively; the second part has 2 digits, 2 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 827-20:
(5*8)+(4*2)+(3*7)+(2*2)+(1*0)=73
73 % 10 = 3
So 827-20-3 is a valid CAS Registry Number.
InChI:InChI=1/C7H5F4N/c8-4-1-2-5(6(12)3-4)7(9,10)11/h1-3H,12H2

827-20-3 Well-known Company Product Price

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  • Alfa Aesar

  • (H26657)  5-Fluoro-2-(trifluoromethyl)aniline, 97%   

  • 827-20-3

  • 1g

  • 1525.0CNY

  • Detail

  • Alfa Aesar

  • (H26657)  5-Fluoro-2-(trifluoromethyl)aniline, 97%   

  • 827-20-3

  • 10g

  • 8814.0CNY

  • Detail

827-20-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 5-Fluoro-2-(trifluoromethyl)aniline

1.2 Other means of identification

Product number -
Other names 5-FLUORO-2-(TRIFLUOROMETHYL)ANILINE

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).

More Details:827-20-3 SDS

827-20-3Relevant articles and documents

Coordinating Activation Strategy-Induced Selective C?H Trifluoromethylation of Anilines

Xu, Jun,Cheng, Ke,Shen, Chao,Bai, Renren,Xie, Yuanyuan,Zhang, Pengfei

, p. 965 - 970 (2018/02/12)

A simple protocol for the synthesis of 2-(trifluoromethyl)aniline derivatives through a coordinating activation strategy was developed. The reaction showed good reactivity and gave the target products in moderate to good yields. Pleasingly, the directing group could be recovered in excellent yield. Furthermore, this strategy allowed efficient access to the synthesis of floctafenine. A single-electron-transfer mechanism was proposed to be responsible for this trifluoromethylation reaction.

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