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947533-51-9 | 5-Trifluoromethyl-pyridine-3-boronic acid

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Purchase CAS:947533-51-9 | 5-Trifluoromethyl-pyridine-3-boronic acid,view related peer-reviewed papers,technical documents,similar products,MSDS & more.“(5-(Trifluoromethyl)pyridin-3-yl)boronic acid” is a chemical compound with the CAS Number: 947533-51-9 . It has a molecular weight of 190.92 and its molecular formula is C6H5BF3NO2 . It is a solid substance and is used as an important raw material and intermediate in organic synthesis, agrochemi...
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CAS:947533-51-9 | 5-Trifluoromethyl-pyridine-3-boronic acid,Description

“(5-(Trifluoromethyl)pyridin-3-yl)boronic acid” is a chemical compound with the CAS Number: 947533-51-9. It has a molecular weight of 190.92and its molecular formula is C6H5BF3NO2. It is a solid substanceand is used as an important raw material and intermediate in organic synthesis, agrochemical, pharmaceutical, and dyestuff fields.

 

Molecular Structure Analysis

The InChI code for “(5-(Trifluoromethyl)pyridin-3-yl)boronic acid” is 1S/C6H5BF3NO2/c8-6(9,10)4-1-5(7(12)13)3-11-2-4/h1-3,12-13H. The Canonical SMILES representation is B(C1=CC(=CN=C1)C(F)(F)F)(O)O. These codes provide a textual representation of the molecule’s structure.

 

Physical And Chemical Properties Analysis

“(5-(Trifluoromethyl)pyridin-3-yl)boronic acid” is a white to yellow solid. It has a molecular weight of 190.92 g/mol. It is slightly soluble in water.

 

Scientific Research Applications

 

  • Agrochemical and Pharmaceutical Compounds
    • Summary of Application : Trifluoromethylpyridine (TFMP) and its intermediates, including “(5-(Trifluoromethyl)pyridin-3-yl)boronic acid”, are important ingredients for the development of agrochemical and pharmaceutical compounds. They have gained a fundamental role as key structural ingredients for the development of many agrochemical and pharmaceutical compounds.
    • Methods of Application : The researchers explore the different synthetic methods for introducing TFMP groups within other molecules. This is generally achieved via two main methods: one involving an exchange between chlorine and fluorine atoms using trichloromethyl-pyridine. The second method relies on the assembly of pyridine from a trifluoromethyl-containing building block.
    • Results or Outcomes : The demand for TFMP derivatives has been increasing steadily in the last 30 years. These compounds have unique biological properties, and their use is expected to continue to grow.

The presence of a fluorine atom and a carbon-containing pyridine are thought to bestow many of the distinctive physical–chemical properties observed with this class of compounds. The demand for TFMP derivatives has been increasing steadily in the last 30 years. These compounds have unique biological properties, and their use is expected to continue to grow.

The presence of a fluorine atom and a carbon-containing pyridine are thought to bestow many of the distinctive physical–chemical properties observed with this class of compounds. The demand for TFMP derivatives has been increasing steadily in the last 30 years. These compounds have unique biological properties, and their use is expected to continue to grow.

Safety And Hazards

“(5-(Trifluoromethyl)pyridin-3-yl)boronic acid” is classified as hazardous according to the 2012 OSHA Hazard Communication Standard (29 CFR 1910.1200). It can cause skin irritation, serious eye irritation, and may cause respiratory irritation. Safety measures include avoiding contact with skin and eyes, avoiding formation of dust and aerosols, and providing appropriate exhaust ventilation at places where dust is formed.

More Information

Product Name:5-Trifluoromethyl-pyridine-3-boronic acid
Synonyms:5-Trifluoromethyl-pyridine-3-boronic acid;3-trifluoromethyl-5-pyridyl boronic acid;(5-Trifluoromethylpyridin-3-yl)boronic acid, 95%;5-TRIFLUOROMETHYL-PYRIDINE-3-BORONIC ACI;BP 33117 5-TRIFLUOROMETHYL-PYRIDINE-3-BORONIC ACID;3-Borono-5-(trifluoromethyl)pyridine;5-TrifluoroMethyl-3-pyridineboric acid;[5-(Trifluoromethyl)-3-pyridyl]boronic acid
CAS:947533-51-9
MF:C6H5BF3NO2
MW:190.92
EINECS: 
Product Categories: 
Mol File:947533-51-9.mol
 
5-Trifluoromethyl-pyridine-3-boronic acid Chemical Properties
Melting point 300.8 °C (decomp)
Boiling point 299.9±50.0 °C(Predicted)
density 1.44±0.1 g/cm3(Predicted)
storage temp. under inert gas (nitrogen or Argon) at 2-8°C
form Crystalline Powder
pka5.90±0.10(Predicted)
color White to yellow

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