133997-05-4

Basic information

• Product Name: 4-(N-OCTYL)BENZENEBORONIC ACID
• Synonyms: AKOS BRN-0161;4-(N-OCTYL)BENZENEBORONIC ACID;4-N-OCTYLPHENYLBORONIC ACID;(4-Octylphenyl)boronic acid
• CAS NO: 133997-05-4
• Molecular Formula: C₁₄H₂₃BO₂
• Molecular Weight: 234.14
• Mol File: 133997-05-4.mol

Chemical Properties

• Boiling Point: 371.2 °C at 760 mmHg
• Flash Point: 178.3 °C
• Appearance: /
• Density: 0.98g/cm³
• Vapor Pressure: 3.62E-06mmHg at 25°C
• Refractive Index: 1.502
• CAS DataBase Reference: 4-(N-OCTYL)BENZENEBORONIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 4-(N-OCTYL)BENZENEBORONIC ACID(133997-05-4)
• EPA Substance Registry System: 4-(N-OCTYL)BENZENEBORONIC ACID(133997-05-4)

Safety Data

• Hazard Codes: Xi
• Hazardous Substances Data: 133997-05-4(Hazardous Substances Data)

Usage

Uses

Used in Organic Synthesis:
4-(N-Octyl)benzeneboronic acid is used as a building block for the synthesis of complex organic molecules, providing a versatile starting material for the creation of a wide range of compounds.
Used in Medicinal Chemistry:
In the field of medicinal chemistry, 4-(N-Octyl)benzeneboronic acid is utilized as a key component in the development of pharmaceuticals, contributing to the design and synthesis of new drug candidates with potential therapeutic applications.
Used in Agrochemical Development:
4-(N-Octyl)benzeneboronic acid is employed in the development of agrochemicals, serving as a crucial component in the synthesis of compounds with pesticidal or herbicidal properties, thereby enhancing crop protection and yield.
Used as a Ligand in Catalytic Reactions:
4-(N-Octyl)benzeneboronic acid is used as a ligand in various catalytic reactions, such as Suzuki-Miyaura cross-coupling and Negishi coupling, due to its ability to complex with transition metals. This application facilitates the formation of carbon-carbon and carbon-heteroatom bonds, which are essential in the synthesis of a broad spectrum of organic compounds.
Used in the Field of Organic Chemistry:
As a versatile and useful reagent, 4-(N-Octyl)benzeneboronic acid is employed across the field of organic chemistry for its potential to contribute to the synthesis of a diverse array of organic compounds and its involvement in important catalytic processes.

InChI:InChI=1/C14H23BO2/c1-2-3-4-5-6-7-8-13-9-11-14(12-10-13)15(16)17/h9-12,16-17H,2-8H2,1H3

Upstream product

• 51554-93-9 1-bromo-4-octylbenzene 
• 121-43-7 Trimethyl borate 

Downstream Products

• 876292-95-4 2,2-dimethyl-1,3-propanediol 4-octylphenylboronate 
• 906001-86-3 1,2-bis(4'-octylbiphenyl-4-yl)ethan-1,2-dione 
• 7116-97-4 4-octyl-1,1′-biphenyl 
• 133997-09-8 Br(CH₂)10CH(CH₂)2O₂BC₆H₄C₈H₁₇ 
• 1167575-35-0 3,9-di(p-octylphenyl)-5,11-di(t-butyloxycarbonyl)indolo[3,2-b]carbazole 
• 1246518-77-3 C₄₀H₄₆N₂S₄ 
• 1246518-78-4 C₄₈H₆₂N₂S₄ 
• 1246518-84-2 C₄₂H₅₀N₂S₄ 
• 1246518-82-0 C₅₆H₇₈N₂S₄ 
• 1245650-92-3 C₄₈H₅₂N₂S₄ 
• 1357159-93-3 2-(4-octylphenyl)-6-decyloxynaphthalene 
• 821781-35-5 2,5-dibromo-3-{10-[6-(4-octylphenyl)naphthalene-2-yloxy]decyl}thiophene 
• 371136-33-3 2-(4-octylphenyl)-6-hydroxynaphthalene 
• 371136-32-2 2-methoxy-6-(4-octylphenyl)naphthalene 

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