57564-18-8

Basic information

• Product Name: 1-hexyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxonicotinonitrile
• Synonyms: 1-Hexyl-2-oxo-1,2-dihydro-4-methyl-6-hydroxypyridine-3-carbonitrile;Einecs 260-812-8;1-hexyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxonicotinonitrile;1-Hexyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-3-pyridinecarbonitrile;1-hexyl-6-hydroxy-4-methyl-2-oxo-1,2-dihydro-3-pyridinecarbonitrile
• CAS NO: 57564-18-8
• Molecular Formula: C₁₃H₁₈N₂O₂
• Molecular Weight: 234.29422
• EINECS: 260-812-8
• Mol File: 57564-18-8.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 360.8°Cat760mmHg
• Flash Point: 172°C
• Appearance: /
• Density: 1.13g/cm³
• Vapor Pressure: 1.16E-06mmHg at 25°C
• Refractive Index: 1.542
• CAS DataBase Reference: 1-hexyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxonicotinonitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 1-hexyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxonicotinonitrile(57564-18-8)
• EPA Substance Registry System: 1-hexyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxonicotinonitrile(57564-18-8)

Safety Data

• Hazardous Substances Data: 57564-18-8(Hazardous Substances Data)

Usage

General Description

1-hexyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxonicotinonitrile is a chemical compound with the molecular formula C15H23N3O2. It is a nicotine derivative with potential insecticidal properties. 1-hexyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxonicotinonitrile has been studied for its ability to act as a potent antagonist of the nicotinic acetylcholine receptor, resulting in paralysis and death of insects. It has shown promise as a potential alternative to traditional insecticides for pest control, particularly in agricultural settings. Additionally, this compound may have potential applications in the pharmaceutical industry for the development of new insecticides with reduced environmental impact. Further research is needed to fully understand the potential uses and safety considerations of 1-hexyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxonicotinonitrile.

InChI:InChI=1/C13H18N2O2/c1-3-4-5-6-7-15-12(16)8-10(2)11(9-14)13(15)17/h8,17H,3-7H2,1-2H3

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Relevant articles and documents

Dimerization of merocyanine dyes. Structural and energetic characterization of dipolar dye aggregates and implications for nonlinear optical materials

Aggregation of polar merocyanine dyes has been identified as an important problem in the fabrication of organic materials for photonic applications. In this work, a series of merocyanine dyes is synthesized, and their aggregation is investigated by a combination of several experimental techniques to reveal structure-property relationships. These studies provide clear evidence for the formation of centrosymmetric dimers for all investigated merocyanines in concentrated solution and in the solid state. The thermodynamics of dimerization in liquid solution is studied by concentration-dependent permittivity measurements, UV-vis spectroscopy, and electrooptical absorption experiments. A centrosymmetric dimer structure with antiparallel ordering of the dipole moments is observed in solution by 2D NMR spectroscopy as well as in the solid state by x-ray crystallography and interpreted in terms of dipolar and π-π interactions. The optical properties of the dimer aggregates are satisfactorily explained by an excitonic coupling model. The effect of an external electric field on the dimerization equilibrium is considered and quantitatively determined by electrooptical absorption measurements. Implications of the observed findings on the design of nonlinear optical and photorefractive materials are discussed.