3598-14-9

Basic information

• Product Name: PHENOXYACETONITRILE
• Synonyms: 2-PHENOXYACETONITRILE;PHENOXYACETONITRILE;Phenoxyacetonirile;Phenoxyacetonitrile,98%;Phenoxymethyl cyanide;Phenoxyacetonitrile 98%
• CAS NO: 3598-14-9
• Molecular Formula: C₈H₇NO
• Molecular Weight: 133.15
• Product Categories: Aromatic Nitriles;C8 to C9;Cyanides/Nitriles;Nitrogen Compounds
• Mol File: 3598-14-9.mol
• Article Data: 24

Chemical Properties

• Boiling Point: 235-238 °C(lit.)
• Flash Point: >230 °F
• Appearance: clear light yellow-brown liquid
• Density: 1.09 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.0381mmHg at 25°C
• Refractive Index: n20/D 1.524(lit.)
• Storage Temp.: 2-8°C
• BRN: 2206192
• CAS DataBase Reference: PHENOXYACETONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: PHENOXYACETONITRILE(3598-14-9)
• EPA Substance Registry System: PHENOXYACETONITRILE(3598-14-9)

Safety Data

• Hazard Codes: Xn
• Statements: 20/21/22
• Safety Statements: 36
• RIDADR: 3276
• WGK Germany: 3
• HazardClass: 6.1
• PackingGroup: III
• Hazardous Substances Data: 3598-14-9(Hazardous Substances Data)

Usage

Description

Phenoxyacetonitrile, also known as 2-phenoxyacetonitrile, is an organic compound that serves as a versatile building block in the synthesis of various pharmaceutical and chemical products. It is a clear light yellow-brown liquid with unique chemical properties that make it suitable for a range of applications.

Uses

Used in Pharmaceutical Industry:
Phenoxyacetonitrile is used as a reactant for the preparation of [[(oxo)pyridazinyl]phenoxy]acetonitrile derivatives, which are known to have vasodilatory effects. These derivatives are valuable in the treatment of cardiovascular diseases, as they help in the relaxation of blood vessels, thereby improving blood flow and reducing blood pressure.
Used in Chemical Synthesis:
Phenoxyacetonitrile is utilized in the synthesis of various compounds, such as 2,4-dihydroxyphenoxyacetophenones, methylthio(phenoxy)acetonitrile, and 2,4-diamino-5-(3,4,5-trimethoxyphenoxy)pyrimidine. These synthesized compounds have potential applications in different industries, including pharmaceuticals, agrochemicals, and materials science.

InChI:InChI=1/C8H7NO/c9-6-7-10-8-4-2-1-3-5-8/h1-5H,7H2

Upstream product

• 107-14-2 chloroacetonitrile 
• 108-95-2 phenol 
• 3229-70-7 phenolate 
• 590-17-0 cyanomethyl bromide 
• 2120-70-9 2-phenoxyethanal 
• 139-02-6 sodium phenoxide 
• 32438-31-6 (2,2-diethoxy-ethoxy)-benzene 
• 2555-49-9 phenoxyacetic acid ethyl ester 
• 122-59-8 2-phenoxyacetic acid 
• 701-99-5 Phenoxyacetyl chloride 
• 621-88-5 phenoxyacetamide 
• 19158-51-1 P-toluenesulfonyl cyanide 
• 100-66-3 methoxybenzene 
• 98-80-6 phenylboronic acid 

Downstream Products

• 105214-06-0 2-(8-nitroquinolin-7-yl)acetonitrile 
• 105199-23-3 (5-Nitro-6-quinolinyl)acetonitrile 
• 105199-28-8 (6-Nitro-5-quinolinyl)acetonitrile 
• 121068-32-4 5-(phenoxymethyl)-1,3,4-thiadiazol-2-amine 
• 105004-01-1 (4-cyano-2-nitro)phenylacetonitrile 
• 105004-00-0 6-cyano-2-nitrophenylacetonitrile 
• 6437-44-1 2-phenoxypropionitrile 
• 7664-41-7 ammonia 
• 122-59-8 2-phenoxyacetic acid 
• 261362-91-8 Isonicotinic acid [1-amino-2-phenoxy-eth-(E)-ylidene]-hydrazide 
• 150563-65-8 (E)-3-[2-(5-methyl-2-phenyl-4-oxazolyl)methyl-5-benzofuranyl]-2-phenoxy-2-propenenitrile 
• 112538-58-6 2-[4-(1-methylprop-1-yloxy)-phenoxy]-ethylamine 
• 110888-09-0 2-amino-3-phenoxy-propionitrile 
• 742051-91-8 1-(phenoxymethyl)cyclopropylamine 

Relevant articles and documents

Direct C(sp3)-H Cyanation Enabled by a Highly Active Decatungstate Photocatalyst

A highly efficient, direct C(sp3)-H cyanation was developed under mild photocatalytic conditions. The method enabled the direct cyanation of various C(sp3)-H substrates with excellent functional group tolerance. Notably, complex natural products and bioactive compounds were efficiently cyanated.

IODONIUM SALT COMPOUND, PHOTOACID GENERATOR AND COMPOSITION CONTAINING THE SAME, AND METHOD FOR MANUFACTURING DEVICE

PROBLEM TO BE SOLVED: To provide an iodonium salt compound which can be used as a chemical amplification type photoacid generator for resist and a photocationic polymerization initiator, has high sensitivity to an i-line at a wavelength of 365 nm, and has high solubility to an organic solvent and a resin. SOLUTION: A new iodonium salt compound is represented by the following iodonium salts 2, 5 and 10. SELECTED DRAWING: Figure 1 COPYRIGHT: (C)2019,JPOandINPIT

Corresponding amine nitrile and method of manufacturing thereof

The invention relates to a manufacturing method of nitrile. Compared with the prior art, the manufacturing method has the characteristics of significantly reduced using amount of an ammonia source, low environmental pressure, low energy consumption, low production cost, high purity and yield of a nitrile product and the like, and nitrile with a more complex structure can be obtained. The invention also relates to a method for manufacturing corresponding amine from nitrile.