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5-Trifluoromethyl-1H-pyrazol-4-ylboronic acid is a boronic acid derivative featuring a pyrazole ring with a trifluoromethyl substituent at the 5th position. It is known for its role in organic synthesis, where it facilitates the formation of carbon-carbon and carbon-heteroatom bonds. The presence of the boronic acid group enables its participation in Suzuki-Miyaura cross-coupling reactions and other transition metal-catalyzed processes. The trifluoromethyl group further enhances the reactivity and selectivity of the compound in various chemical transformations, making it a versatile chemical entity with applications across different fields.

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  • 1202054-12-3 Structure
  • Basic information

    1. Product Name: 5-TRIFLUOROMETHYL-1H-PYRAZOL-4-YLBORONIC ACID
    2. Synonyms: 5-TRIFLUOROMETHYL-1H-PYRAZOL-4-YLBORONIC ACID;Boronic acid, B-[3-(trifluoroMethyl)-1H-pyrazol-4-yl]-
    3. CAS NO:1202054-12-3
    4. Molecular Formula: C4H4BF3N2O2
    5. Molecular Weight: 179.8929696
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 1202054-12-3.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 388.4±52.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.60±0.1 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
    8. Solubility: N/A
    9. PKA: 7.25±0.58(Predicted)
    10. CAS DataBase Reference: 5-TRIFLUOROMETHYL-1H-PYRAZOL-4-YLBORONIC ACID(CAS DataBase Reference)
    11. NIST Chemistry Reference: 5-TRIFLUOROMETHYL-1H-PYRAZOL-4-YLBORONIC ACID(1202054-12-3)
    12. EPA Substance Registry System: 5-TRIFLUOROMETHYL-1H-PYRAZOL-4-YLBORONIC ACID(1202054-12-3)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 1202054-12-3(Hazardous Substances Data)

1202054-12-3 Usage

Uses

Used in Medicinal Chemistry:
5-Trifluoromethyl-1H-pyrazol-4-ylboronic acid is used as a synthetic intermediate for the development of pharmaceutical compounds. Its unique structure allows for the functionalization of complex molecules, contributing to the discovery of new drugs with improved therapeutic properties.
Used in Agrochemical Synthesis:
In the agrochemical industry, 5-Trifluoromethyl-1H-pyrazol-4-ylboronic acid is utilized as a reagent in the synthesis of agrochemicals. Its ability to form carbon-heteroatom bonds aids in the creation of novel agrochemicals with enhanced efficacy and selectivity.
Used in Material Science:
5-Trifluoromethyl-1H-pyrazol-4-ylboronic acid is employed as a building block in the synthesis of advanced materials. Its versatile nature allows for the development of materials with unique properties, such as improved stability, reactivity, or selectivity, which can be applied in various technological applications.
Used in Organic Synthesis:
As a reagent in organic synthesis, 5-Trifluoromethyl-1H-pyrazol-4-ylboronic acid is used for the formation of carbon-carbon and carbon-heteroatom bonds. Its participation in Suzuki-Miyaura cross-coupling reactions and other transition metal-catalyzed processes enables the synthesis of complex organic molecules with high selectivity and efficiency.

Check Digit Verification of cas no

The CAS Registry Mumber 1202054-12-3 includes 10 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 7 digits, 1,2,0,2,0,5 and 4 respectively; the second part has 2 digits, 1 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 1202054-12:
(9*1)+(8*2)+(7*0)+(6*2)+(5*0)+(4*5)+(3*4)+(2*1)+(1*2)=73
73 % 10 = 3
So 1202054-12-3 is a valid CAS Registry Number.

1202054-12-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name [5-(trifluoromethyl)-1H-pyrazol-4-yl]boronic acid

1.2 Other means of identification

Product number -
Other names 5-Trifluoromethyl-1h-pyrazol-4-ylboronic 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:1202054-12-3 SDS

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