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

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

Downstream Products

• 227954-23-6 methanesulfonic acid 3-(4-fluorophenyl)prop-2-ynyl ester 
• 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 
• 1448667-80-8 (2S,4S)-1-(2,2-diphenylacetyl)-4-((3-(4-fluorophenyl)prop-2-yn-1-yl)(methyl)amino)piperidine-2-carboxylic acid 
• 1448668-23-2 C₃₁H₃₁FN₂O₃ 
• 1448667-81-9 (2S,4R)-1-(2,2-diphenylacetyl)-4-((3-(4-fluorophenyl)prop-2-yn-1-yl)(methyl)amino)piperidine-2-carboxylic acid 
• 1448668-24-3 C₃₁H₃₁FN₂O₃ 
• 1448668-26-5 C₃₀H₂₈FNO₄ 
• 1448668-25-4 C₁₁H₇Cl₃FNO 
• 1443055-26-2 5-butyl-4-(4-fluorophenyl)-3-hydroxy-5-methylfuran-2(5H)-one 
• 1443055-19-3 methyl 2-((3-(4-fluorophenyl)prop-2-yn-1-yl)oxy)acetate 
• 1443989-41-0 5-(4-fluorophenyl)-2,2-dimethylpent-4-ynal 
• 1443989-43-2 (E)-6-(4-fluorobenzylidene)-1,8,8-trimethyloctahydropyrrolo[1,2-a]pyrimidine 

Relevant articles and documents

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

Efficient Synthesis of Polysubstituted Furans through a Base-Promoted Oxacyclization of (Z)-2-En-4-yn-1-ols

An efficient base catalyzed oxacyclization of Z-enynols has been developed under transition metal-free reaction conditions, thus resulting in a variety of new di-, tri-, and tetra-substituted furans. This approach allowed us to obtain 32 new compounds. Furthermore, DFT calculations were realized to depict a relationship between the natural population analysis and experimental results with alkyl or aryl groups for the synthesis of 2-benzylfuran. A one-pot Sonogashira/oxacyclization approach offers a flexible, robust and efficient alternative to base catalyzed cyclization is also carried out.

Transition-metal-free and facile synthesis of 3-alkynylpyrrole-2,4-dicarboxylates from methylene isocyanides and propiolaldehyde

A transition-metal-free, facile and efficient method for the synthesis of 3-alkynylpyrrole-2,4-dicarboxylates from methylene isocyanides and propiolaldehyde with moderate to good yields has been developed. The direct transformation process and good tolerance of various substituents make it an alternative approach to previous protocols, and potential applications of these investigated compounds are expected with or without post-modifications.