106316-02-3

Basic information

• Product Name: 4-N-DECYLOXY-2-FLUOROBENZOIC ACID
• Synonyms: 2-FLUORO-4-DECYLOXYBENZOIC ACID;4-DECYLOXY-2-FLUOROBENZOIC ACID;4-N-DECYLOXY-2-FLUOROBENZOIC ACID;4-Decyloxy-2-fluorobenzoic acid 93%;4-Decyloxy-2-fluorobenzoicacid93%
• CAS NO: 106316-02-3
• Molecular Formula: C₁₇H₂₅FO₃
• Molecular Weight: 296.38
• Product Categories: Benzoic acid;Acids & Esters;Anisoles, Alkyloxy Compounds & Phenylacetates;Fluorine Compounds
• Mol File: 106316-02-3.mol

Chemical Properties

• Boiling Point: 392.8 °C at 760 mmHg
• Flash Point: 191.3 °C
• Appearance: /
• Density: 1.063 g/cm³
• Vapor Pressure: 7.13E-07mmHg at 25°C
• Refractive Index: 1.496
• CAS DataBase Reference: 4-N-DECYLOXY-2-FLUOROBENZOIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 4-N-DECYLOXY-2-FLUOROBENZOIC ACID(106316-02-3)
• EPA Substance Registry System: 4-N-DECYLOXY-2-FLUOROBENZOIC ACID(106316-02-3)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36
• Hazardous Substances Data: 106316-02-3(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
4-N-Decyloxy-2-fluorobenzoic acid is used as a building block in organic synthesis for the development of pharmaceuticals. Its unique chemical properties allow for the creation of new drug candidates with potential therapeutic benefits.
Used in Agrochemical Industry:
In the agrochemical industry, 4-N-Decyloxy-2-fluorobenzoic acid is utilized as a precursor in the synthesis of various agrochemicals. Its chemical properties make it suitable for the development of new compounds with applications in crop protection and pest control.
Used in Research and Development:
4-N-Decyloxy-2-fluorobenzoic acid is used as a research compound to explore its potential applications and properties. Its unique structure and chemical characteristics make it an interesting subject for scientific investigation, potentially leading to new discoveries and applications in various fields.

InChI:InChI=1/C17H25FO3/c1-2-3-4-5-6-7-8-9-12-21-14-10-11-15(17(19)20)16(18)13-14/h10-11,13H,2-9,12H2,1H3,(H,19,20)

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Relevant articles and documents

Controlling Mirror Symmetry Breaking and Network Formation in Liquid Crystalline Cubic, Isotropic Liquid and Crystalline Phases of Benzil-Based Polycatenars

Spontaneous development of chirality in systems composed of achiral molecules is important for new routes to asymmetric synthesis, chiral superstructures and materials, as well as for the understanding of the mechanisms of emergence of prebiotic chirality. Herein, it is shown that the 4,4′-diphenylbenzil unit is a universal transiently chiral bent building block for the design of multi-chained (polycatenar) rod-like molecules capable of forming a wide variety of helically twisted network structures in the liquid, the liquid crystalline (LC) and the crystalline state. Single polar substituents at the apex of tricatenar molecules support the formation of the achiral (racemic) cubic double network phase with Ia (Formula presented.) d symmetry and relatively small twist along the networks. The combination of an alkyl chain with fluorine substitution leads to the homogeneously chiral triple network phase with I23 space group, and in addition, provides a mirror symmetry broken liquid. Replacing F by Cl or Br further increases the twist, leading to a short pitch double gyroid Ia (Formula presented.) d phase, which is achiral again. The effects of the structural variations on the network structures, either leading to achiral phases or chiral conglomerates are analyzed.

Influence of fluoro substituents on the mesophase behaviour of banana-shaped molecules

Three new series of bent-shaped five-ring liquid crystals, based on the ester of isophthalic acid as the central core and azomethine linkages, are presented. They differ by the number and the position of halogeno substituents on the outer rings. This lateral substitution strongly influences the type of mesophases formed. Calculations were performed to determine the modification of the distribution of charge along the different molecules.

The Effect of 2- and 3-Lateral Substituents on the Acid Side of 4,4'-Disubstituted Phenylbenzoates and Phenylthiobenzoates on Mesomorphic Properties

A variety of esters/thioesters of the type where A or B = F, Cl, Me; Z = O, S and Y = C10, OC10, COC9, CO2C9 and OCOC9 for Z = O and C5, C10, OC7, OC10 for Z = S and R = C8H17, C10H21, C12H25 were synthesized and their mesomorphic properties det