(3-Cyano-4-fluorobenzene)boronic acid

(3-Cyano-4-fluorobenzene)boronic acid - Names and Identifiers

Name	3-Cyano-4-fluorobenzeneboronic acid
Synonyms	2-Fluoro-5-boronobenzonitrile 5-Borono-2-fluorobenzonitrile 3-Cyano-4-fluorophenylboronci acid 3-CYANO-4-FLUOROPHENYLBORONIC ACID 3-Cyano-4-fluorophneylboronic acid 3-Cyano-4-fluorophenylboronic acid 3-Cyano-4-fluorophenyl)boronic acid 3-Cyano-4-fluorobenzeneboronic acid (3-Cyano-4-fluorobenzene)boronic acid (3-CYANO-4-FLUOROBENZENE)BORONIC ACID 3-Cyano-4-fluorophenylboronic Acid (contains varying aMounts of Anhydride)
CAS	214210-21-6
InChI	InChI=1/C7H5BFNO2/c9-7-2-1-6(8(11)12)3-5(7)4-10/h1-3,11-12H

(3-Cyano-4-fluorobenzene)boronic acid - Physico-chemical Properties

Molecular Formula	C7H5BFNO2
Molar Mass	164.93
Density	1.35±0.1 g/cm3(Predicted)
Melting Point	>300
Boling Point	333.2±52.0 °C(Predicted)
Flash Point	155.3°C
Solubility	slightly sol. in Methanol
Vapor Presure	5.52E-05mmHg at 25°C
Appearance	Crystallization
Color	White to Almost white
pKa	7.26±0.10(Predicted)
Storage Condition	Keep in dark place,Sealed in dry,Room Temperature
Refractive Index	1.535

(3-Cyano-4-fluorobenzene)boronic acid - Risk and Safety

Hazard Symbols	Xi - Irritant
Risk Codes	R20/21/22 - Harmful by inhalation, in contact with skin and if swallowed. R36/37/38 - Irritating to eyes, respiratory system and skin. R41 - Risk of serious damage to eyes R37/38 - Irritating to respiratory system and skin.
Safety Description	S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36/37/39 - Wear suitable protective clothing, gloves and eye/face protection. S39 - Wear eye / face protection.
UN IDs	3439
Hazard Note	Harmful/Keep Cold
Hazard Class	IRRITANT

(3-Cyano-4-fluorobenzene)boronic acid - Introduction

acid is an organic compound with the chemical formula C7H5BFNO2. The following is a description of the properties, uses, preparation and safety information of the compound:

Nature:
-Appearance: colorless or slightly yellow crystal
-Solubility: Soluble in ethanol and dimethyl sulfoxide, slightly soluble in water
-Melting Point: about 140-143 ℃
-Stability: stable at room temperature, but avoid contact with strong oxidants

Use:
-acid is an important organic synthetic intermediate, usually as a derivative of Phenylboronic acid, which is widely used in organic synthetic chemical reactions.
-It can be used to introduce cyano and fluorine atoms into the target molecule for the synthesis of drugs, pesticides, functional materials and other organic compounds.

Method:
Li acid can be obtained by the reaction of Phenylboronic acid and 3-cyano-4-fluorophenyl sulfone. First, Phenylboronic acid was reacted with thionyl chloride to give Phenylboronic acid dichloroester, and then reacted with 3-cyano-4-fluorophenylsulfone under alkaline conditions to give acid.

Safety Information:
-The specific toxicity and safety information of acid is currently rarely reported, so it is necessary to pay attention to appropriate protective measures during use, such as wearing gloves, safety glasses and protective clothing.

Last Update：2024-04-09 21:01:54