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115029-24-8

2-FLUORO-4-(TRIFLUOROMETHYL)BENZOIC ACID is a chemical compound characterized by its molecular properties, which have been studied using molecular orbital and empirical methods. It is known for its steric and electronic properties, and it appears as white crystals.

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  • 115029-24-8 Structure

  • Basic information

    1. Product Name: 2-FLUORO-4-(TRIFLUOROMETHYL)BENZOIC ACID
    2. Synonyms: 2-fluoro-4-(rifluoromethyl)benzoic acid;2-Fluoro-4-(trifluoromethyl)benzoic acid,99%;α,α,α,2-Tetrafluoro-p-toluic acid;4-Carboxy-3-fluorobenzotrifluoride, 4-Carboxy-alpha,alpha,alpha,3-tetrafluorotoluene;4-Carboxy-3-fluorobenzotrifluoride, alpha,alpha,alpha,2-Tetrafluoro-p-toluic acid;2-Fluoro-4-(trifluoroMethyl)benzoic acid;RARECHEM AL BO 0632;2-FLUORO-4-(TRIFLUOROMETHYL)BENZOIC ACID
    3. CAS NO:115029-24-8
    4. Molecular Formula: C8H4F4O2
    5. Molecular Weight: 208.11
    6. EINECS: N/A
    7. Product Categories: Carboxylic Acids;Phenyls & Phenyl-Het;Miscellaneous;Carboxylic Acids;Phenyls & Phenyl-Het;C8;Carbonyl Compounds;Fluorine series;Fluorobenzene;Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts
    8. Mol File: 115029-24-8.mol

  • Chemical Properties

    1. Melting Point: 168-170 °C(lit.)
    2. Boiling Point: 231.4 °C at 760 mmHg
    3. Flash Point: 93.7 °C
    4. Appearance: white crystals
    5. Density: 1.4412 (estimate)
    6. Vapor Pressure: 0.0349mmHg at 25°C
    7. Refractive Index: N/A
    8. Storage Temp.: Sealed in dry,Room Temperature
    9. Solubility: N/A
    10. PKA: 2.76±0.10(Predicted)
    11. BRN: 8409774
    12. CAS DataBase Reference: 2-FLUORO-4-(TRIFLUOROMETHYL)BENZOIC ACID(CAS DataBase Reference)
    13. NIST Chemistry Reference: 2-FLUORO-4-(TRIFLUOROMETHYL)BENZOIC ACID(115029-24-8)
    14. EPA Substance Registry System: 2-FLUORO-4-(TRIFLUOROMETHYL)BENZOIC ACID(115029-24-8)

  • Safety Data

    1. Hazard Codes: Xi
    2. Statements: 36/37/38-37/38-36
    3. Safety Statements: 26-37/39-36/37/39-27
    4. WGK Germany: 3
    5. RTECS:
    6. HazardClass: IRRITANT
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 115029-24-8(Hazardous Substances Data)

115029-24-8 Usage

Uses

Used in Pharmaceutical Industry:
2-FLUORO-4-(TRIFLUOROMETHYL)BENZOIC ACID is used as an intermediate in the synthesis of various pharmaceutical compounds due to its unique molecular properties and reactivity.
Used in Chemical Synthesis:
In the chemical industry, 2-FLUORO-4-(TRIFLUOROMETHYL)BENZOIC ACID is used as a building block for the creation of more complex molecules, taking advantage of its specific steric and electronic characteristics.
Used in Research and Development:
2-FLUORO-4-(TRIFLUOROMETHYL)BENZOIC ACID is also utilized in research and development settings to study its properties and potential applications in various fields, including material science and drug discovery.

Check Digit Verification of cas no

The CAS Registry Mumber 115029-24-8 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,5,0,2 and 9 respectively; the second part has 2 digits, 2 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 115029-24:
(8*1)+(7*1)+(6*5)+(5*0)+(4*2)+(3*9)+(2*2)+(1*4)=88
88 % 10 = 8
So 115029-24-8 is a valid CAS Registry Number.
InChI:InChI=1/C8H4F4O2/c9-6-3-4(8(10,11)12)1-2-5(6)7(13)14/h1-3H,(H,13,14)/p-1

115029-24-8 Well-known Company Product Price

  • Brand
  • (Code)Product description
  • CAS number
  • Packaging
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  • Detail

  • Alfa Aesar

  • (L09571)  2-Fluoro-4-(trifluoromethyl)benzoic acid, 98+%   

  • 115029-24-8

  • 1g

  • 551.0CNY

  • Detail

  • Alfa Aesar

  • (L09571)  2-Fluoro-4-(trifluoromethyl)benzoic acid, 98+%   

  • 115029-24-8

  • 5g

  • 1852.0CNY

  • Detail

  • Alfa Aesar

  • (L09571)  2-Fluoro-4-(trifluoromethyl)benzoic acid, 98+%   

  • 115029-24-8

  • 25g

  • 7285.0CNY

  • Detail

  • Aldrich

  • (310867)  2-Fluoro-4-(trifluoromethyl)benzoicacid  99%

  • 115029-24-8

  • 310867-5G

  • 2,329.47CNY

  • Detail

115029-24-8SDS

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 2-Fluoro-4-(Trifluoromethyl)Benzoic Acid

1.2 Other means of identification

Product number -
Other names 2-Fluoro-4-(trifluoromethyl)benzoic acid

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:115029-24-8 SDS

115029-24-8Relevant articles and documents

Method for synthesizing 2-fluoro-4-trifluoromethylbenzoic acid

-

Paragraph 0011, (2017/09/06)

The invention discloses a method for synthesizing 2-fluoro-4-trifluoromethylbenzoic acid. After chlorobenzotrifluoride serves as a raw material and undergoes selective proton abstraction together with 2,2,6,6-tetramethyl piperidine magnesium chloride or 2

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