119584-74-6

Basic information

• Product Name: 2-FLUORO-6-(2,2,2-TRIFLUOROETHOXY)BENZONITRILE
• Synonyms: 2-FLUORO-6-(2,2,2-TRIFLUOROETHOXY)BENZENECARBONITRILE;2-FLUORO-6-(2,2,2-TRIFLUOROETHOXY)BENZONITRILE;BUTTPARK 51\09-76
• CAS NO: 119584-74-6
• Molecular Formula: C₉H₅F₄NO
• Molecular Weight: 219.14
• Mol File: 119584-74-6.mol
• Article Data: 3

Chemical Properties

• Melting Point: 88 °C
• Boiling Point: 232 °C at 760mmHg
• Flash Point: 94.1 °C
• Appearance: /
• Density: 1.37 g/cm³
• Vapor Pressure: 0.0604mmHg at 25°C
• Refractive Index: 1.448
• Storage Temp.: 2-8°C
• CAS DataBase Reference: 2-FLUORO-6-(2,2,2-TRIFLUOROETHOXY)BENZONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-FLUORO-6-(2,2,2-TRIFLUOROETHOXY)BENZONITRILE(119584-74-6)
• EPA Substance Registry System: 2-FLUORO-6-(2,2,2-TRIFLUOROETHOXY)BENZONITRILE(119584-74-6)

Safety Data

• Hazard Codes: T
• Statements: 20/21/22-36/37/38-25
• Safety Statements: 26-36/37/39-45
• HazardClass: TOXIC
• Hazardous Substances Data: 119584-74-6(Hazardous Substances Data)

Usage

General Description

2-FLUORO-6-(2,2,2-TRIFLUOROETHOXY)BENZONITRILE is a chemical compound with the molecular formula C9H4F4NO and a molar mass of 215.13 g/mol. It is a white solid with a faint odor and is soluble in organic solvents such as methanol and dichloromethane. 2-FLUORO-6-(2,2,2-TRIFLUOROETHOXY)BENZONITRILE is commonly used as a building block in the synthesis of pharmaceuticals, agrochemicals, and other specialty chemicals. It is also used as a reagent in organic chemistry reactions, particularly in the production of aromatic compounds. Additionally, it is known to be a potential herbicide and has been studied for its potential use in controlling the growth of certain weeds and plants.

InChI:InChI=1/C9H5F4NO/c10-7-2-1-3-8(6(7)4-14)15-5-9(11,12)13/h1-3H,5H2

Upstream product

• 75-89-8 2,2,2-trifluoroethanol 
• 1897-52-5 2,6 difluorobenzonitrile 

Downstream Products

• 119584-82-6 5-(2,2,2-trifluoroethoxy)-2,4-diaminoquinazoline 
• 907609-06-7 2-fluoro-6-(2,2,2-trifluoroethoxy)benzaldehyde 

Relevant articles and documents

USE OF A QUINAZOLINE COMPOUND IN PREPARING A MEDICAMENT AGAINST FLAVIVIRIDAE VIRUS

Disclosed is a use of a quinazoline compound of Formula I having 2,4-diaminoquinazoline as a parent nucleus in preparation of a medicament for treating diseases caused by flaviviridae infection, especially a use in combating Hepatitis C virus infection and Dengue fever virus infection.

Direct Synthesis of 2,4-Diaminoquinazolines from 2-Fluorobenzonitriles

In a search for new methods for preparing 2,4-diaminoquinazolines having a diversity of substituents in the benzenoid ring, it was found that the reaction of 2,6-difluorbenzonitrile with guanidine carbonate gave 2,4-diamino-5-fluoroquinazoline in excellent yield.Extension of this approach to other 2-fluorobenzonitriles, some of which were elaborated for the first time, showed that this reaction possesses considerable generality.The cyclization was sucessful even when electron donating groups were present at position six.Only in two cases where a primary or secondary amino group was also present ortho to the cyano group was this transformation unsucessful.