214822-96-5

Basic information

• Product Name: METHYL 4-FLUORO-3-HYDROXYBENZOATE
• Synonyms: METHYL 4-FLUORO-3-HYDROXYBENZOATE;Methyl 4-fluoro-3-hydroxybenzoate, 98+%;4-Fluoro-3-hydroxybenzoic Acid Methyl Ester;2-Fluoro-5-(methoxycarbonyl)phenol
• CAS NO: 214822-96-5
• Molecular Formula: C₈H₇FO₃
• Molecular Weight: 170.14
• Product Categories: Aromatic Esters;Phenylacetic acid;Acids & Esters;Fluorine Compounds;Phenols
• Mol File: 214822-96-5.mol
• Article Data: 18

Chemical Properties

• Melting Point: 89-91°C
• Boiling Point: 268.9 °C at 760 mmHg
• Flash Point: 116.4 °C
• Appearance: /
• Density: 1.309 g/cm³
• Solubility: soluble in Methanol
• PKA: 7.89±0.10(Predicted)
• CAS DataBase Reference: METHYL 4-FLUORO-3-HYDROXYBENZOATE(CAS DataBase Reference)
• NIST Chemistry Reference: METHYL 4-FLUORO-3-HYDROXYBENZOATE(214822-96-5)
• EPA Substance Registry System: METHYL 4-FLUORO-3-HYDROXYBENZOATE(214822-96-5)

Safety Data

• Statements: 36/37/38
• Safety Statements: 26-36/37/39
• Hazardous Substances Data: 214822-96-5(Hazardous Substances Data)

Usage

General Description

METHYL 4-FLUORO-3-HYDROXYBENZOATE is a chemical compound with the molecular formula C8H7FO3. It is an ester derived from methyl alcohol and 4-fluoro-3-hydroxybenzoic acid. METHYL 4-FLUORO-3-HYDROXYBENZOATE is commonly used as an intermediate in the synthesis of pharmaceuticals and agrochemicals. It has potential applications in the field of medicine and agriculture due to its structural properties. METHYL 4-FLUORO-3-HYDROXYBENZOATE is also used as a flavoring agent and in the production of fragrances. However, it is important to handle this chemical with care as it may pose health and environmental risks if not properly managed.

Upstream product

• 67-56-1 methanol 
• 51446-31-2 4-fluoro-3-hydroxybenzoic acid 
• 403-33-8 methyl 4-flurobenzoate 
• 757982-31-3 methyl 4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate 
• 149-73-5 trimethyl orthoformate 

Downstream Products

• 1446701-54-7 3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)-propoxy]-4-fluoro-benzoic acid methyl ester 

Relevant articles and documents

Rhodium-Catalyzed Twofold Unsymmetrical C-H Alkenylation-Annulation/Thiolation Reaction to Access Thiobenzofurans

A Rh(III)-catalyzed twofold unsymmetrical C-H alkenylation-annulation/thiolation reaction has been developed, enabling the straightforward and efficient synthesis of various thiobenzofurans in one step. This robust protocol proceeds with a broad substrate scope and good functional group tolerance under relatively mild reaction conditions.

URACIL CONTAINING COMPOUNDS

Provided herein are dUTPase inhibitors, compositions comprising such compounds and methods of using such compounds and compositions.

Sulfoximine-Assisted One-Pot Unsymmetrical Multiple Annulation of Arenes: A Combined Experimental and Computational Study

Discussed herein is an unprecedented Ru-catalyzed one-pot unsymmetrical C-H difunctionalization of arenes comprising intramolecular hydroarylation of olefins and intermolecular annulation of alkynes. This unprecedented 2-fold C-H functionalization is validated on the basis of experimental and density functional theory (DFT) study. The transformation readily occurs with the assistance of methylphenyl sulfoximine (MPS) directing group in the presence of Ru catalyst forming two C-C and one C-N bonds in a single operation. The overall process is atom economical and step-efficient and provides unusual dihydrofuran-fused isoquinolone heterocycles. Further annulation of NH and the proximal o-C-H-arene of isoquinolone with alkynes build highly conjugated novel polycyclic compounds. Overall, three independent annulations in arene motifs are visualized and thoughtfully executed; finally, 5 ring-fused structural entities are constructed forming three C-C and two C-N bonds.