Description

1-(Iodomethyl)-2-Oxabicyclo[2.1.1]Hexane-4-Carbonitrile is a high-value, functionalized bicyclic building block designed for advanced synthetic chemistry. This compound is critical for medicinal chemistry research and the development of novel active pharmaceutical ingredients (APIs) due to its unique strained ring system and reactive iodomethyl handle. It is primarily sought by R&D chemists and process development scientists in the pharmaceutical, agrochemical, and specialty chemical industries for constructing complex molecular architectures.

Application

• Pharmaceutical Intermediate: A key synthon for the synthesis of novel drug candidates, particularly in fragment-based drug discovery and for introducing constrained, three-dimensional scaffolds.
• Medicinal Chemistry: Used in structure-activity relationship (SAR) studies to explore new chemical space and improve the pharmacokinetic properties of lead compounds.
• Agrochemical Research: Serves as a building block for developing new active ingredients with unique modes of action.
• Chemical Biology: Employed as a probe or linker in bioconjugation and chemical biology studies due to its reactive iodine moiety.
• Material Science: Potential monomer or cross-linking agent for creating polymers with specialized thermal or mechanical properties.
• Academic Research: Used in methodological development for ring-opening and cross-coupling reactions involving strained bicyclic systems.

Basic Information

Product Name	1-(Iodomethyl)-2-Oxabicyclo[2.1.1]Hexane-4-Carbonitrile
CAS No.	2230803-78-6
Molecular Formula	C8H8INO
Molecular Weight	261.06 g/mol
Synonyms	1-(Iodomethyl)-2-oxabicyclo[2.1.1]hexane-4-carbonitrile; 2-Oxabicyclo[2.1.1]hexane-4-carbonitrile, 1-(iodomethyl)-; 4-Cyano-1-(iodomethyl)-2-oxabicyclo[2.1.1]hexane; 1-Iodomethyl-2-oxabicyclo[2.1.1]hexane-4-carbonitrile; Bicyclo[2.1.1]hexane-4-carbonitrile, 1-(iodomethyl)-2-oxa-; Oxabicyclohexanecarbonitrile derivative
EINECS	Contact for details

Quality Control

Our 1-(Iodomethyl)-2-Oxabicyclo[2.1.1]Hexane-4-Carbonitrile is produced under strict quality management protocols. Each batch undergoes rigorous analytical testing, including HPLC, NMR, and MS, to ensure high chemical purity and identity confirmation. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing all relevant specifications. Our quality systems support development under cGMP guidelines for pharmaceutical applications.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (15-25°C). Keep the container sealed to prevent moisture absorption and degradation. Handle and store in accordance with all applicable local and international regulations.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (HPLC)	Conforms
Identification (NMR)	Conforms
Purity (HPLC)	≥ 95.0%
Water Content (KF)	≤ 0.5%
Residual Solvents (GC)	Meets ICH guidelines

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