Description

3-(Isocyanomethyl)Benzyl-Isocyanide is a versatile bifunctional organic building block containing both isocyanide and isocyanomethyl functional groups. This unique structure makes it a valuable intermediate for the synthesis of complex heterocycles and functionalized molecules in medicinal chemistry and materials science. It is primarily utilized by research chemists and process development scientists in the pharmaceutical, agrochemical, and specialty chemical industries for constructing novel molecular scaffolds.

Application

• Pharmaceutical Intermediate: Key building block for the synthesis of novel drug candidates, particularly in multi-component reactions (MCRs) like the Ugi and Passerini reactions.
• Agrochemical Research: Used in the development of new active ingredients for crop protection agents, leveraging its reactivity to create diverse chemical libraries.
• Ligand Synthesis: Serves as a precursor for the preparation of specialized ligands used in catalysis and coordination chemistry.
• Polymer Chemistry: Employed in the creation of functional polymers and dendrimers with tailored properties.
• Chemical Biology Probes: Useful for synthesizing activity-based probes and bioconjugation reagents due to its reactive handles.
• Heterocyclic Compound Synthesis: A critical reagent for constructing complex nitrogen-containing heterocycles, which are common motifs in bioactive molecules.

Basic Information

Product Name	3-(Isocyanomethyl)Benzyl-Isocyanide
CAS No.	188540-42-3
Molecular Formula	C10H8N2
Molecular Weight	156.19 g/mol
Synonyms	1,3-Phenylenedimethyl diisocyanide; m-Xylylene diisocyanide; 1,3-Bis(isocyanomethyl)benzene; 3-(Isocyanomethyl)benzyl isonitrile; Benzene-1,3-diyldimethanediyl diisocyanide; m-Diisocyanomethylbenzene; 1,3-Bis(isonitrilomethyl)benzene; 3-(Isocyanomethyl)phenylmethyl isocyanide
EINECS	Contact for details

Quality Control

Our 3-(Isocyanomethyl)Benzyl-Isocyanide is produced under strict quality management protocols. Each batch undergoes comprehensive analytical testing, including HPLC, NMR, and FTIR, to ensure high purity and consistent performance. A detailed Certificate of Analysis (COA) is provided with every shipment, confirming compliance with customer specifications and industry standards for research and development use.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at room temperature (15-25°C). This compound is hygroscopic (moisture-sensitive) and should be handled under an inert atmosphere (e.g., nitrogen or argon) for long-term stability and to prevent degradation.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 95.0%
Water Content (KF)	≤ 0.5%

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