64468-77-5

Basic information

• Product Name: 4-FURAN-2-YL-BENZONITRILE
• Synonyms: 4-FURAN-2-YL-BENZONITRILE;4-(2-FURYL)BENZONITRILE;AKOS BAR-0090;2-(4-Cyanophenyl)furan;4-(2-Furanyl)benzonitrile
• CAS NO: 64468-77-5
• Molecular Formula: C₁₁H₇NO
• Molecular Weight: 169.18
• Mol File: 64468-77-5.mol
• Article Data: 46

Chemical Properties

• Melting Point: 65-66℃
• Boiling Point: 301.7 °C at 760 mmHg
• Flash Point: 136.3 °C
• Appearance: /
• Density: 1.18 g/cm³
• Vapor Pressure: 0.00104mmHg at 25°C
• Refractive Index: 1.596
• CAS DataBase Reference: 4-FURAN-2-YL-BENZONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: 4-FURAN-2-YL-BENZONITRILE(64468-77-5)
• EPA Substance Registry System: 4-FURAN-2-YL-BENZONITRILE(64468-77-5)

Safety Data

• Hazard Codes: Xi
• Hazardous Substances Data: 64468-77-5(Hazardous Substances Data)

Usage

General Description

4-Furan-2-yl-benzonitrile is a chemical compound which appears to be relatively uncommon in scientific literature. The structure consists of a benzene ring, which is a six-sided carbon ring with alternating single and double bonds, attached to a CN group, forming the compound called benzonitrile. This is further attached to a furan, a ring of four carbons and one oxygen. As a result, the molecular structure of this chemical compound is quite complex. Additional information about this chemical, such as its uses or properties, is not readily available. Therefore, it might be used in specialized areas of chemical, pharmaceutical, or materials research which are not well-documented.

InChI:InChI=1/C11H7NO/c12-8-9-3-5-10(6-4-9)11-2-1-7-13-11/h1-7H

Upstream product

• 110-00-9 furan 
• 1194-02-1 4-fluorobenzonitrile 
• 623-00-7 4-bromobenzenecarbonitrile 
• 14297-34-8 2-(p-bromophenyl)furane 
• 544-92-3 copper(I) cyanide 
• 64468-76-4 4-(5-Methoxy-2,5-dihydro-furan-2-yl)-benzonitrile 
• 81745-86-0 2-furylzinc chloride 
• 2786-02-9 2-lithiofuran 
• 118486-94-5 2-(tributylstannyl)furan 
• 873-74-5 4-Aminobenzonitrile 
• 623-03-0 4-Cyanochlorobenzene 
• 879904-83-3 2-(hydroxydimethylsilyl)furan 
• 623-26-7 terephthalonitrile 
• 166328-14-9 potassium (furan-2-yl)trifluoroboranuide 

Downstream Products

• 591735-87-4 2-(4-amidinophenyl)furan 
• 591735-79-4 2-(4-N-hydroxyamidinophenyl)furan 
• 1346754-74-2 dimethyl 6-(4-cyanophenyl)-3-hydroxyphthalate 
• 875929-96-7 4-(5-bromofuran-2-yl)benzonitrile 
• 591735-85-2 2-(4-acetoxyamidinophenyl)-5-(4-methoxyamidinophenyl)furan 
• 591735-95-4 2-(4-benzyloxyamidinophenyl)-5-(4-cyanophenyl)furan 
• 591735-99-8 2-(4-N-acetylamidinophenyl)-5-(4-hydroxyamidinophenyl)furan 
• 591735-91-0 2-(4-N-butoxycarbonylamidinophenyl)-5-(4-cyanophenyl)furan 
• 475976-08-0 2-(4-hydroxyamidinophenyl)-5-(4-methoxyamidinophenyl)furan 
• 591735-97-6 2-(4-N-acetylamidinophenyl)-5-(4-cyanophenyl)furan 
• 591735-83-0 2-(4-cyanophenyl)-5-(4-N-methoxyamidinophenyl)furan 
• 591735-93-2 2-(4-benzyloxyamidinophenyl)furan 
• 591735-89-6 2-(4-N-butoxycarbonylamidinophenyl)furan 
• 591735-81-8 2-(4-N-methoxyamidinophenyl)furan 

Relevant articles and documents

“TPG-lite”: A new, simplified “designer” surfactant for general use in synthesis under micellar catalysis conditions in recyclable water

Using the oxidized, carboxylic acid-containing form of MPEG-750, esterification with racemic vitamin E affords a new surfactant (TPG-lite) that functions as an enabling, nanoreactor-forming amphiphile for use in many types of important reactions in synthesis. The presence of a single ester bond is suggestive of simplified treatment as a component of (eventual) reaction waste water, after recycling. Many types of reactions, including aminations, Suzuki-Miyaura, SNAr, and several others are compared directly with TPGS-750-M, leading to the conclusion that TPG-lite can function as an equivalent nanomicelle-forming surfactant in water. Prima facie evidence amassed via DLS and cryo-TEM analyses support these experimental observations. In silico evaluations of the aquatic toxicity and carcinogenicity of TPG-lite indicate that it is safe to use.

Switching between mono and doubly reduced odd alternant hydrocarbon: designing a redox catalyst

Since the early Hückel molecular orbital (HMO) calculations in 1950, it has been well known that the odd alternant hydrocarbon (OAH), the phenalenyl (PLY) system, can exist in three redox states: closed shell cation (12π e?), mono-reduced open shell neutral radical (13π e?) and doubly reduced closed shell anion (14π e?). Switching from one redox state of PLY to another leads to a slight structural change owing to its low energy of disproportionation making the electron addition or removal process facile. To date, mono-reduced PLY based radicals have been extensively studied. However, the reactivity and application of doubly reduced PLY species have not been explored so far. In this work, we report the synthesis of the doubly reduced PLY species (14π e?) and its application towards the development of redox catalysisviaswitching with the mono-reduced form (13π e?) for aryl halide activation and functionalization under transition metal free conditions without any external stimuli such as heat, light or cathodic current supply.

UiO-66 microcrystals catalyzed direct arylation of enol acetates and heteroarenes with aryl diazonium salts in water

UiO-66 is a classic Metal–organic framework (MOF) that constructed by zirconium cations and terephthalate with high chemical and thermal stability. Using pristine UiO-66 nanocrystals as the catalysts, the carbon–carbon bond formation based on denitrogenat