5468-34-8

Basic information

• Product Name: 2-AMINO-3-CYANO-4,6-DIMETHYLPYRIDINE
• Synonyms: 2-AMINO-4,6-DIMETHYL-NICOTINONITRILE;2-AMINO-3-CYANO-4,6-DIMETHYLPYRIDINE;OTAVA-BB BB7110951376;NSC25393;2-amino-4,6-dimethylpyridine-3-carbonitrile;2-azanyl-4,6-dimethyl-pyridine-3-carbonitrile;2-amino-4,6-dimethylnicotinonitrile(SALTDATA: FREE);2-amino-4,6-dimethyl-3-pyridinecarbonitrile
• CAS NO: 5468-34-8
• Molecular Formula: C₈H₉N₃
• Molecular Weight: 147.18
• Product Categories: Pyridines
• Mol File: 5468-34-8.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 316.7 °C at 760 mmHg
• Flash Point: 145.4 °C
• Appearance: /
• Density: 1.14 g/cm³
• Vapor Pressure: 0.000402mmHg at 25°C
• Refractive Index: 1.566
• Storage Temp.: 2-8°C
• CAS DataBase Reference: 2-AMINO-3-CYANO-4,6-DIMETHYLPYRIDINE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-AMINO-3-CYANO-4,6-DIMETHYLPYRIDINE(5468-34-8)
• EPA Substance Registry System: 2-AMINO-3-CYANO-4,6-DIMETHYLPYRIDINE(5468-34-8)

Safety Data

• Hazardous Substances Data: 5468-34-8(Hazardous Substances Data)

Usage

General Description

2-Amino-3-cyano-4,6-dimethylpyridine is a chemical compound with a molecular formula C8H8N2. It is a pyridine derivative that contains an amino group, a cyano group, and two methyl groups. This chemical has potential applications in various fields, including pharmaceuticals and organic synthesis. It can be used as a building block in the synthesis of pharmaceuticals and agrochemicals. Additionally, 2-amino-3-cyano-4,6-dimethylpyridine can also be used in the production of dyes, pigments, and other organic compounds. Overall, this chemical compound has versatile properties that make it valuable in various industries.

InChI:InChI=1/C8H9N3/c1-5-3-6(2)11-8(10)7(5)4-9/h3H,1-2H3,(H2,10,11)

Upstream product

• 123-54-6 acetylacetone 
• 109-77-3 malononitrile 

Downstream Products

• 857486-64-7 N-(2-amino-4,6-dimethyl-[3]pyridylmethyl)-benzamide 
• 721938-81-4 N-(2-amino-4,6-dimethyl-[3]pyridylmethyl)-acetamide 
• 769-28-8 2-hydroxy-4,6-dimethyl-3-carbonitrile 
• 96551-20-1 2-amino-3-aminomethyl-4,6-dimethylpyridine 

Relevant articles and documents

Synthesis, physicochemical and vibrational spectral properties of 2–pyridone and 2–aminopyridine derivatives: An experimental and theoretical study

A convenient and efficient one–pot three–component reaction of acetyl acetone, malononitrile and ammonium acetate was investigated for the synthesis of 3–cyano–4,6–dimethyl–2–pyridone (PI) and 2–amino–3–cyano–4,6–dimethylpyridine (PII). The products were achieved with high purity, high yields and short reaction time. The yields of the two products depend on the concentration of ammonium acetate, reaction time and the solvent used. The structures of the isolated products were confirmed by elemental analysis and spectral data, supported by quantum chemical (MP2) calculations, both in gas phase and solvents (water and ethanol), that were also employed to track the reaction mechanisms and model vibrational spectral properties for final characterization and interpretation of spectral data. A remarkable matching between theoretical predictions and experiments was attained both for the geometrical parameters, as compared to X-Ray data available in the literature, and for vibrational frequencies, leading to a correlation coefficient (R2) of 0.99. Molecular docking was further studied to predict the docking binding energy of the synthesized compounds with the target proteins.