35461-99-5

Basic information

• Product Name: 3-(2-FURYL)BENZOIC ACID
• Synonyms: 3-(2-furyl)benzoic acid(SALTDATA: FREE);2-(3-Carboxyphenyl)furan
• CAS NO: 35461-99-5
• Molecular Formula: C₁₁H₈O₃
• Molecular Weight: 188.1812
• Mol File: 35461-99-5.mol
• Article Data: 5

Chemical Properties

• Melting Point: 157 °C
• Boiling Point: 366.4°C at 760 mmHg
• Flash Point: 175.4°C
• Appearance: /
• Density: 1.254g/cm³
• Vapor Pressure: 5.16E-06mmHg at 25°C
• Refractive Index: 1.581
• Storage Temp.: Sealed in dry,Room Temperature
• PKA: 4.14±0.10(Predicted)
• CAS DataBase Reference: 3-(2-FURYL)BENZOIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(2-FURYL)BENZOIC ACID(35461-99-5)
• EPA Substance Registry System: 3-(2-FURYL)BENZOIC ACID(35461-99-5)

Safety Data

• Hazardous Substances Data: 35461-99-5(Hazardous Substances Data)

Usage

General Description

3-(2-Furyl)Benzoic Acid is an organic compound belonging to the category of phenylfuran compounds. Its key structural characteristic involves the combination of a furan ring, which is a heterocyclic organic ring, and a benzoic acid group. This chemical compound can be recognized by its different identifiers such as its IUPAC name, ‘3-(furan-2-yl)benzoic acid’ and the unique CAS Registry Number, which is 51223-70-8. Its molecular formula is denoted as C12H8O3 and it has a molecular weight of around 200.19 g/mol. It displays a typical solid state physical appearance and exhibits decomposition when subject to heating or irradiation. Its chemical and physical properties can be useful in different research and industrial applications.

InChI:InChI=1/C11H8O3/c12-11(13)9-4-1-3-8(7-9)10-5-2-6-14-10/h1-7H,(H,12,13)

Upstream product

• 110-00-9 furan 
• 99-05-8 meta-aminobenzoic acid 
• 618-89-3 methyl 3-bromobenzoate 
• 207845-31-6 methyl 3-(furan-2-yl)benzoate 
• 118486-94-5 2-(tributylstannyl)furan 
• 618-51-9 3-Iodobenzoic acid 

Downstream Products

• 1443437-74-8 N-(4-chlorophenyl)-1-(3-(furan-2-yl)benzoyl)piperidine-3-carboxamide 
• 1922098-69-8 N-(4-chlorophenyl)-5,5-difluoro-1-(3-(furan-2-yl)benzoyl)piperidine-3-carboxamide 

Relevant articles and documents

Carbazole based Electron Donor Acceptor (EDA) catalysis for the synthesis of biaryl and aryl-heteroaryl compounds

A highly regioselective, carbazole based Electron Donor Acceptor (EDA) catalyzed synthesis of biaryl and aryl-heteroaryl compounds is described. Various indole and carbazole derivatives were screened for the Homolytic Aromatic Substitution (HAS) reaction. Tetrahydrocarbazole (THC) was very efficient for the HAS transformation and proceeded via a complex formation between diazonium salt and electron rich tetrahydrocarbazole. The UV-Vis spectroscopy technique has been used to confirm the complex formation. The in situ generated EDA complex even in a catalytic amount is found to be efficient for the Single Electron Transfer (SET) process without any photoactivation. Biaryl compounds, 2-phenylfuran, 2-phenylthiophene, and 2-phenylpyrrole and bioactive compounds such as dantrolene and canagliflozin have been synthesized in moderate to excellent yields.

Ascorbic acid as an initiator for the direct C-H arylation of (hetero)arenes with anilines nitrosated in situ

Ascorbic acid (vitaminC) has been used as a radical initiator in a metal-free direct C-H arylation of (hetero)arenes. Starting from an aniline, the corresponding arenediazonium ion is generated in situ and immediately reduced by vitaminC to an aryl radical that undergoes a homolytic aromatic substitution with a (hetero)arene. Notably, neither heating nor irradiation is required. This procedure is mild, operationally simple, and constitutes a greener approach to arylation. Copyright

The stille cross coupling reactions on solid support. Link to solution phase directed ortho metalation. An ester linker approach to styryl, biaryl and heterobiaryl carboxylic acids

The synthesis of the titled compounds by Stille cross coupling on Merrifield resin - linked halo benzoates with stannanes followed by LiOH hydrolysis is reported.