91692-70-5

Basic information

• Product Name: 2-CHLORO-6-PHENOXYBENZONITRILE
• Synonyms: 2-CHLORO-6-PHENOXYBENZONITRILE
• CAS NO: 91692-70-5
• Molecular Formula: C₁₃H₈ClNO
• Molecular Weight: 229.66
• Product Categories: Aromatic Nitriles
• Mol File: 91692-70-5.mol
• Article Data: 6

Chemical Properties

• Melting Point: 61-63°C
• Boiling Point: 351°Cat760mmHg
• Flash Point: 166.1°C
• Appearance: /
• Density: 1.29g/cm³
• Vapor Pressure: 4.23E-05mmHg at 25°C
• Refractive Index: 1.622
• BRN: 2728571
• CAS DataBase Reference: 2-CHLORO-6-PHENOXYBENZONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-CHLORO-6-PHENOXYBENZONITRILE(91692-70-5)
• EPA Substance Registry System: 2-CHLORO-6-PHENOXYBENZONITRILE(91692-70-5)

Safety Data

• Statements: 22
• Safety Statements: 22-36/37
• RIDADR: 3276
• HazardClass: 6.1
• PackingGroup: III
• Hazardous Substances Data: 91692-70-5(Hazardous Substances Data)

Usage

General Description

2-Chloro-6-phenoxybenzonitrile is a chemical compound with the molecular formula C13H8ClNO. It is a white crystalline powder that is soluble in organic solvents and has a molecular weight of 233.66 g/mol. 2-CHLORO-6-PHENOXYBENZONITRILE is commonly used as a pesticide and herbicide due to its ability to inhibit plant growth by disrupting the synthesis of plant hormones. It is primarily utilized in the agricultural industry for controlling weeds and preventing the growth of unwanted vegetation. 2-Chloro-6-phenoxybenzonitrile is considered to be toxic to aquatic organisms and may pose a risk to the environment if not handled and disposed of properly.

InChI:InChI=1/C13H8ClNO/c14-12-7-4-8-13(11(12)9-15)16-10-5-2-1-3-6-10/h1-8H

Upstream product

• 668-45-1 2-chloro-6-fluorobenzonitrile 
• 108-95-2 phenol 
• 175136-89-7 2-aminomethyl-3-chlorodiphenylether 

Downstream Products

• 175136-89-7 2-aminomethyl-3-chlorodiphenylether 

Relevant articles and documents

Dual inhibitors of LSD1 and spermine oxidase

We have previously described the synthesis and evaluation of 3,5-diamino-1,2,4-triazole analogues as inhibitors of the flavin-dependent histone demethylase LSD1. These compounds are potent inhibitors of LSD1 without activity against monoamine oxidases A and B, and promote the elevation of H3K4me2 levels in tumor cells in vitro. We now report that the cytotoxicity of these analogues in pancreatic tumor cells correlates with the overexpression of LSD1 in each tumor type. In addition, we show that a subset of these 3,5-diamino-1,2,4-triazole analogues inhibit a related flavin-dependent oxidase, the polyamine catabolic enzyme spermine oxidase (SMOX) in vitro.

"Nanorust"-catalyzed benign oxidation of amines for selective synthesis of nitriles

Organic nitriles constitute key precursors and central intermediates in organic synthesis. In addition, nitriles represent a versatile motif found in numerous medicinally and biologically important compounds. Generally, these nitriles are synthesized by traditional cyanation procedures using toxic cyanides. Herein, we report the selective and environmentally benign oxidative conversion of primary amines for the synthesis of structurally diverse aromatic, aliphatic and heterocyclic nitriles using a reusable "nanorust" (nanoscale Fe2O3)-based catalysts applying molecular oxygen.

Synthesis of imides, N-acyl vinylogous carbamates and ureas, and nitriles by oxidation of amides and amines with dess-martin periodinane

Expanding our synthetic tool repertoire: The DMP-mediated oxidation of a range of amide substrates has been demonstrated, affording the corresponding imides and N-acyl vinylogous carbamates and ureas. Likewise, an array of benzylic and related amines have also been successfully converted into their nitrile counterparts (see scheme; DMP = Dess-Martin periodinane). (Chemical Equation Presented)