179942-55-3

Basic information

• Product Name: 4-(2H-TETRAZOL-5-YL)-PHENYLBORONIC ACID
• Synonyms: 4-(2H-TETRAZOL-5-YL)-PHENYLBORONIC ACID;4-(1H-Tetrazol-5-yl)-phenylboronic acid
• CAS NO: 179942-55-3
• Molecular Formula: C₇H₇BN₄O₂
• Molecular Weight: 189.97
• Product Categories: Boronate Ester;Boronic Acid;Potassium Trifluoroborate
• Mol File: 179942-55-3.mol

Chemical Properties

• Melting Point: 174-179°C (Decomposition)
• Boiling Point: 480.3°Cat760mmHg
• Flash Point: 244.2°C
• Appearance: /
• Density: 1.51g/cm³
• Vapor Pressure: 4.93E-10mmHg at 25°C
• Refractive Index: 1.641
• Storage Temp.: 2-8°C
• PKA: 4.11±0.10(Predicted)
• CAS DataBase Reference: 4-(2H-TETRAZOL-5-YL)-PHENYLBORONIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 4-(2H-TETRAZOL-5-YL)-PHENYLBORONIC ACID(179942-55-3)
• EPA Substance Registry System: 4-(2H-TETRAZOL-5-YL)-PHENYLBORONIC ACID(179942-55-3)

Safety Data

• WGK Germany: 3
• Hazardous Substances Data: 179942-55-3(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
4-(2H-TETRAZOL-5-YL)-PHENYLBORONIC ACID is used as a reactant for palladium-catalyzed carbon-carbon bond formation in the Suzuki-Miyaura reaction, which is a widely employed method for the synthesis of biologically active compounds, including pharmaceuticals. The Suzuki-Miyaura reaction allows for the formation of new carbon-carbon bonds between an aryl or vinyl boronic acid and an aryl or vinyl halide or triflate, enabling the creation of complex molecular structures with potential therapeutic applications.
Used in Chemical Synthesis:
4-(2H-TETRAZOL-5-YL)-PHENYLBORONIC ACID is used as a building block in the synthesis of various organic compounds, including heterocycles, natural products, and materials with specific properties. The tetrazole ring provides unique reactivity and stability, making it a valuable component in the design and synthesis of novel molecules with potential applications in various fields, such as medicine, agrochemistry, and materials science.
Used in Research and Development:
4-(2H-TETRAZOL-5-YL)-PHENYLBORONIC ACID is utilized as a research tool in the development of new synthetic methods and catalysts for cross-coupling reactions. Its unique reactivity and the ability to form stable intermediates make it an attractive candidate for the design of new catalysts and ligands that can improve the efficiency and selectivity of palladium-catalyzed reactions.

InChI:InChI=1/C7H7BN4O2/c13-8(14)6-3-1-5(2-4-6)7-9-11-12-10-7/h1-4,13-14H,(H,9,10,11,12)

Downstream Products

• 1454555-19-1 (2-methoxy-ethyl)-{3-[4-(1H-tetrazol-5-yl)-phenyl]-pyrazolo[1,5-a]pyrimidin-5-yl}-amine 
• 1021916-62-0 6-(4-(2H-tetrazol-5-yl)phenyl)-1-(cyclohexylmethyl)-1H-imidazo[4,5-b]pyrazin-2(3H)-one 
• 74815-22-8 4-(1H-1,2,3,4-tetrazol-5-yl)benzaldehyde 
• 890842-77-0 1-[(4-methylphenyl)sulfonyl]-5-phenyl-3-[4-(1H-tetrazol-5-yl)phenyl]-1H-pyrrolo[2,3-b]pyridine 
• 1371587-45-9 2-(4-(1H-tetrazol-5-yl)phenyl)-3-methylquinolin-6-ol 
• 1371588-17-8 2-(4-(1H-tetrazol-5-yl)phenyl)-6-methoxy-3-methylquinoline 
• 1354812-91-1 5-{3-(4-fluoro-2-methyl-phenyl)-1-[(E)-hydroxyimino]-3-[4'-(1H-tetrazol-5-yl)-biphenyl-4-yl]-propyl}-1-methyl-1H-pyridin-2-one 
• 1168723-11-2 3-(3-(1H-tetrazol-5-yl)phenyl)-1-((2-(trimethylsilyl)ethoxy)methyl)-1H-indazole-6-carbaldehyde 
• 1026029-40-2 C₁₁H₇ClN₆ 

Relevant articles and documents

2-METHYLMORPHOLINE PYRIDO-, PYRAZO- AND PYRIMIDO-PYRIMIDINE DERIVATIVES AS MTOR INHIBITORS

There is provided a compound of Formula (I), or a pharmaceutically acceptable salt thereof. There are also provided processes for the manufacture of a compound of Formula (1), and the use of a compound of Formula (1) as a medicament and in the treatment of cancer