Description

2-(4-Iodophenyl)-6-Methyl-1,3,6,2-Dioxazaborocane-4,8-Dione is a specialized organoboron heterocyclic compound with the CAS registry number 1257649-56-1. This chemical is a valuable synthetic intermediate and building block, prized for its unique boron-containing dioxazaborocane core and the reactive iodophenyl moiety. It is primarily sought after by research institutions and pharmaceutical developers engaged in advanced organic synthesis, medicinal chemistry, and materials science.

Application

• Pharmaceutical Intermediate: Serves as a key precursor in the synthesis of novel drug candidates, particularly in boron neutron capture therapy (BNCT) research and the development of enzyme inhibitors.
• Organic Synthesis Building Block: Utilized in Suzuki-Miyaura and other palladium-catalyzed cross-coupling reactions due to the presence of the iodine atom, enabling the construction of complex biaryl structures.
• Materials Science Research: Investigated for the development of advanced polymeric materials, liquid crystals, or organic electronic components where the boron center can impart unique electronic properties.
• Agrochemical Development: Employed in the research and synthesis of new active ingredients with potential herbicidal or pesticidal activity.
• Chemical Biology Probes: Used to create labeled compounds or probes for studying biological processes and target engagement.
• Academic & Industrial R&D: A critical reagent for method development and exploring new reaction pathways in organometallic and heterocyclic chemistry.

Basic Information

Item	Details
Product Name	2-(4-Iodophenyl)-6-Methyl-1,3,6,2-Dioxazaborocane-4,8-Dione
CAS No.	1257649-56-1
Molecular Formula	C12H13BINO4
Molecular Weight	385.95 g/mol
Synonyms	6-Methyl-2-(4-iodophenyl)-1,3,6,2-dioxazaborocane-4,8-dione; 2-(4-Iodophenyl)-6-methyl-1,3,6,2-dioxazaborinane-4,8-dione; 4,8-Dioxa-6-methyl-2-(4-iodophenyl)-1,3,6,2-diazaborocane; Boron heterocycle CAS 1257649-56-1; Iodophenyl dioxazaborocane dione
EINECS	Contact for details

Quality Control

Our 2-(4-Iodophenyl)-6-Methyl-1,3,6,2-Dioxazaborocane-4,8-Dione is produced under strict quality management protocols. Each batch undergoes rigorous analytical testing, including HPLC for purity and NMR for structural confirmation, to ensure consistency and compliance with research-grade specifications. A comprehensive Certificate of Analysis (COA) detailing identity, purity, and impurity profiles is provided with every shipment.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry place at a controlled room temperature (15-25°C). Due to its hygroscopic nature, the container should be kept in a desiccated environment to prevent moisture uptake, which may affect stability and reactivity.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 95%
Water Content (KF)	≤ 1.0%
Residue on Ignition	≤ 0.5%

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.