Description

2-tert-Butylpyrimidine-5-Carbonitrile is a high-purity, heterocyclic organic compound featuring a pyrimidine core substituted with a nitrile group and a bulky tert-butyl moiety. This specific molecular architecture makes it a valuable and versatile chemical intermediate for advanced synthesis. It is primarily utilized by research and development teams in the pharmaceutical and agrochemical industries for constructing complex active molecules.

Application

• Pharmaceutical Intermediate: A key building block in the synthesis of novel active pharmaceutical ingredients (APIs), particularly for candidates targeting central nervous system (CNS) disorders, oncology, and antiviral applications.
• Agrochemical Synthesis: Serves as a precursor for developing advanced herbicides, fungicides, and insecticides, where the pyrimidine ring system is a common pharmacophore.
• Material Science Research: Used in the development of organic electronic materials, such as ligands for metal-organic frameworks (MOFs) or components for organic light-emitting diodes (OLEDs).
• Ligand and Catalyst Development: The nitrile and pyrimidine nitrogen atoms make it a suitable starting material for creating specialized ligands used in homogeneous catalysis.
• Chemical Biology Probes: Employed in medicinal chemistry for the design and synthesis of molecular probes to study biological pathways and enzyme functions.
• Custom Synthesis and Contract Manufacturing: A critical raw material for fine chemical manufacturers offering bespoke synthesis services to the life sciences sector.

Basic Information

Product Name	2-tert-Butylpyrimidine-5-Carbonitrile
CAS No.	126230-72-6
Molecular Formula	C9H11N3
Molecular Weight	161.21 g/mol
Synonyms	5-Cyano-2-tert-butylpyrimidine; 2-(1,1-Dimethylethyl)-5-pyrimidinecarbonitrile; 2-tert-Butyl-5-cyanopyrimidine; 2-(tert-Butyl)pyrimidine-5-carbonitrile; Pyrimidine-5-carbonitrile, 2-(1,1-dimethylethyl)-; 126230-72-6; 2-tert-butylpyrimidine-5-carbonitrile
EINECS	Contact for details

Quality Control

Our 2-tert-Butylpyrimidine-5-Carbonitrile is manufactured under a strict quality management system. Every batch undergoes comprehensive analytical testing, including HPLC, GC, NMR, and mass spectrometry, to ensure identity, purity, and consistency. We provide a detailed Certificate of Analysis (COA) with each shipment, confirming compliance with agreed specifications. Our quality commitment supports applications requiring GMP-grade intermediates and research chemicals.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, well-ventilated area at controlled room temperature (15-25°C). Keep away from strong oxidizing agents, strong acids, and strong bases. For long-term storage, consider an inert atmosphere to maintain optimal purity.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (HPLC)	Retention time matches reference standard
Purity (HPLC)	≥ 98.0%
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%
Heavy Metals	≤ 20 ppm

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