1-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-pyrazole

Basic Information

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CAS Number

852227-94-2

Molecular Formula

C15H19BN2O2

Molecular Weight

270.14 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

395.7°C at 760 mmHg

Density

1.08

Flash Point

193.1°C

Refractive Index

1.546

SMILES

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CC1(C)OB(OC1(C)C)c2cccc(c2)n3cccn3

InChI

InChI=1S/C15H19BN2O2/c1-14(2)15(3,4)20-16(19-14)12-7-5-8-13(11-12)18-10-6-9-17-18/h5-11H,1-4H3

InChIKey

GVSCNAOZDQCWJJ-UHFFFAOYSA-N

LogP

2.1715

Topological Polar Surface Area

36.28 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

346

Synonyms & References

English

1-[3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]-1H-PYRAZOLE
1-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaboranlan-2-yl)phenyl]-1H-pyrazole
1-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyrazole
1-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1H-pyrazole
3-(1H-Pyrazol-1-yl)benzeneboronic acid,pinacol ester

MDL Number

MFCD07368520

FAQ

What is 1-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-pyrazole (CAS: 852227-94-2)?

1-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-pyrazole is a chemical compound with the CAS number 852227-94-2. It is a complex organic molecule that can be used in various applications such as pharmaceuticals and synthetic chemistry. This compound typically exists as a solid at room temperature and is characterized by its dioxaborolane functional group and pyrazole ring structure.

What are the main uses of 1-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-pyrazole (CAS: 852227-94-2)?

1-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-pyrazole (CAS: 852227-94-2) is primarily used in pharmaceutical research and development, particularly in medicinal chemistry and synthetic drug design. It also has potential applications in organic synthesis and as a reagent in various chemical reactions.

Is 1-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-pyrazole (CAS: 852227-94-2) safe?

1-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-pyrazole (CAS: 852227-94-2) is generally considered safe for use in laboratory settings when appropriate safety measures are followed. However, it is important to handle this compound with care, wearing appropriate personal protective equipment such as gloves and goggles. Ensure good ventilation and avoid contact with skin and eyes.

How should 1-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-pyrazole (CAS: 852227-94-2) be stored?

1-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1H-pyrazole (CAS: 852227-94-2) should be stored in a cool, dry place away from direct sunlight and heat sources. It is recommended to keep the compound in a tightly sealed container to prevent degradation. Store it at room temperature or below 25°C to ensure optimal stability and quality.