80151-28-6

Basic information

• Product Name: 3-(4-FLUORO-PHENYL)-PROP-2-YN-1-OL
• Synonyms: AKOS PRN-0021;3-(4-FLUOROPHENYL)PRO-2-YN-1-OL;3-(4-FLUORO-PHENYL)-PROP-2-YN-1-OL;2-Propyn-1-ol, 3-(4-fluorophenyl)- (9CI);3-(4-Fluorophenyl)-2-propyn-1-ol;EOS-62081
• CAS NO: 80151-28-6
• Molecular Formula: C₉H₇FO
• Molecular Weight: 150.15
• Mol File: 80151-28-6.mol
• Article Data: 61

Chemical Properties

• Boiling Point: 236.7 °C at 760 mmHg
• Flash Point: 109.7 °C
• Appearance: /
• Density: 1.2 g/cm³
• Vapor Pressure: 0.0256mmHg at 25°C
• Refractive Index: 1.558
• PKA: 13.00±0.10(Predicted)
• CAS DataBase Reference: 3-(4-FLUORO-PHENYL)-PROP-2-YN-1-OL(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(4-FLUORO-PHENYL)-PROP-2-YN-1-OL(80151-28-6)
• EPA Substance Registry System: 3-(4-FLUORO-PHENYL)-PROP-2-YN-1-OL(80151-28-6)

Safety Data

• Hazard Codes: Xi
• Hazardous Substances Data: 80151-28-6(Hazardous Substances Data)

Usage

General Description

3-(4-Fluoro-phenyl)-prop-2-yn-1-ol is a chemical compound with the molecular formula C9H7FO. It is a white solid that is used in the synthesis of various pharmaceuticals and organic compounds. 3-(4-FLUORO-PHENYL)-PROP-2-YN-1-OL is an alcohol and a propargyl alcohol derivative, which means it contains a triple bond between the second and third carbon atoms in the propynyl group. It also contains a fluorine-substituted phenyl group, which gives it distinctive chemical and physical properties. 3-(4-FLUORO-PHENYL)-PROP-2-YN-1-OL is often used as an intermediate in the synthesis of other chemicals and can be found in various research and industrial applications.

InChI:InChI=1/C9H7FO/c10-9-5-3-8(4-6-9)2-1-7-11/h3-6,11H,7H2

Upstream product

• 42122-44-1 methyl 3-(4-fluorophenyl)propiolate 
• 352-34-1 4-fluoro-1-iodobenzene 
• 107-19-7 propargyl alcohol 
• 460-00-4 1-Bromo-4-fluorobenzene 
• 462-06-6 fluorobenzene 
• 766-98-3 1-ethynyl-4-fluorobenzene 
• 50-00-0 formaldehyd 
• 130995-12-9 1-(4-fluorophenyl)-2-trimethylsilylacetylene 
• 19070-80-5 n-<(trimethylsiloxy)methyl>phthalimide 

Downstream Products

• 74929-23-0 3-(4-fluorophenyl)-2-propynal 
• 40274-29-1 1-(3-bromoprop-1-yn-1-yl)-4-fluorobenzene 
• 227954-23-6 methanesulfonic acid 3-(4-fluorophenyl)prop-2-ynyl ester 
• 862972-85-8 3-(allyloxy)-1-(4-fluorophenyl)-1-propyne 
• 923026-22-6 ethyl {[3-(4-fluorophenyl)prop-2-yn-1-yl]oxy}acetate 
• 942594-94-7 (Z)-3-(4-fluorophenyl)-3-(4-iodophenyl)allyl alcohol 
• 952744-99-9 C₃₀H₂₇FO₄S 
• 942594-95-8 methyl (Z)-[4-[3-(4-fluorophenyl)-3-(4-iodophenyl)allyloxy]-2-methylphenoxy]acetate 
• 923026-27-1 2-{[3-(4-fluorophenyl)prop-2-yn-1-yl]oxy}-N-methyl-N-methoxyacetamide 
• 923026-43-1 1-{[3-(4-fluorophenyl)prop-2-yn-1-yl]oxy}-4-phenylbut-3-yn-2-one 
• 501098-93-7 2-[3-(4-Fluoro-phenyl)-prop-2-yn-(E)-ylidene]-succinic acid 1-ethyl ester 
• 109034-30-2 1-(4-fluorophenyl)-5-phenyl-1,4-pentadiyn-3-ol 

Relevant articles and documents

RECEPTOR INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USE THEREOF

The present invention discloses a receptor inhibitor of formula (I), a pharmaceutical composition comprising the same and the use thereof.

Enantioselective Nickel-Catalyzed Alkyne-Azide Cycloaddition by Dynamic Kinetic Resolution

The triazole heterocycle has been widely adopted as an isostere for the amide bond. Many native amides are α-chiral, being derived from amino acids. This makes α-N-chiral triazoles attractive building blocks. This report describes the first enantioselective triazole synthesis that proceeds via nickel-catalyzed alkyne-azide cycloaddition (NiAAC). This dynamic kinetic resolution is enabled by a spontaneous [3,3]-sigmatropic rearrangement of the allylic azide. The 1,4,5-trisubstituted triazole products, derived from internal alkynes, are complementary to those commonly obtained by the related CuAAC reaction. Initial mechanistic experiments indicate that the NiAAC reaction proceeds through a monometallic Ni complex, which is distinct from the CuAAC manifold.

Bi(OTf)3-catalyed One-pot Synthesis of α-Halo-β-amino Ketones and Acyl Aziridines from 3-Aryl Propargyl Alcohols

A Bi(OTf)3-catalyed reaction of 3-aryl propargyl alcohols with sulfonamide and halogen source was firstly investigated, which provided a facile route for the synthesis of a large variety of α-halo-β-amino ketones. The key intermediates, β-amino