184577-40-0

Basic information

• Product Name: 1-Phenyl-4-hexyn-3-ol
• Synonyms: 1-Phenyl-4-hexyn-3-ol;α-1-Propynylbenzenepropanol;a-1-Propynylbenzenepropanol
• CAS NO: 184577-40-0
• Molecular Formula: C₁₂H₁₄O
• Molecular Weight: 174.24
• Product Categories: Aromatics Compounds;Aromatics
• Mol File: 184577-40-0.mol
• Article Data: 9

Chemical Properties

• Boiling Point: 74-76 °C(Press: 0.05 Torr)
• Appearance: /
• Density: 1.028±0.06 g/cm3(Predicted)
• Solubility: Chloroform, Dichloromethane, Ethyl Acetate
• PKA: 13.00±0.20(Predicted)
• CAS DataBase Reference: 1-Phenyl-4-hexyn-3-ol(CAS DataBase Reference)
• NIST Chemistry Reference: 1-Phenyl-4-hexyn-3-ol(184577-40-0)
• EPA Substance Registry System: 1-Phenyl-4-hexyn-3-ol(184577-40-0)

Safety Data

• Hazardous Substances Data: 184577-40-0(Hazardous Substances Data)

Usage

Description

1-Phenyl-4-hexyn-3-ol, with the CAS number 184577-40-0, is a pale yellow oil compound that is useful in organic synthesis. It is characterized by its unique structure, which includes a phenyl group attached to a hexyn-3-ol moiety.

Uses

Used in Organic Synthesis:
1-Phenyl-4-hexyn-3-ol is used as a synthetic intermediate for the production of various organic compounds. Its unique structure allows it to be a versatile building block in the synthesis of pharmaceuticals, agrochemicals, and other specialty chemicals.
Used in Pharmaceutical Industry:
1-Phenyl-4-hexyn-3-ol is used as a key intermediate in the synthesis of certain pharmaceutical compounds. Its unique structure can be modified to create new drug candidates with potential therapeutic applications.
Used in Agrochemical Industry:
1-Phenyl-4-hexyn-3-ol is used as a precursor in the synthesis of agrochemicals, such as pesticides and herbicides. Its unique structure can be tailored to create new agrochemicals with improved efficacy and selectivity.
Used in Specialty Chemicals:
1-Phenyl-4-hexyn-3-ol is used as a building block in the synthesis of specialty chemicals, such as fragrances, dyes, and other functional materials. Its unique structure can be modified to create new specialty chemicals with specific properties and applications.

Upstream product

• 104-53-0 3-phenyl-propionaldehyde 
• 16466-97-0 1-propynylmagnesium bromide 
• 10486-71-2 sodium propynide 
• 84733-04-0 (3S)-3-(tert-butyldimethylsiloxy)-5-phenyl-1-pentyne 
• 99902-35-9 5-phenylpent-1-yn-3-ol 
• 140149-77-5 5-phenyl-1-trimethylsilylpent-1-yn-3-ol 
• 74-88-4 methyl iodide 
• 4529-04-8 1-propynyl lithium 

Downstream Products

• 83333-73-7 (E)-1-phenylhex-4-en-3-ol 
• 83334-11-6 (Z)-6-phenyl-4-hydroxy-hex-2-ene 
• 122124-41-8 1-phenylhex-4-yn-3-one 
• 1345594-20-8 (3-methylhepta-3,4-diene-1,7-diyl)dibenzene 
• 1345593-79-4 diethyl 1-phenyl-4-hexyn-3-yl phosphate 
• 1354723-16-2 diphenyl 1-phenyl-4-hexynyl phosphate 
• 103240-58-0 2,6-diphenylhexa-2,3-diene 
• 1286679-72-8 (E)-ethyl 3-methyl-7-phenyl-4-heptenoate 
• 1215180-93-0 diethyl (Z)-6-phenyl-2-hexen-4-yl phosphate 
• 1253739-33-1 (R,E)-6-phenyl-3-hexen-2-yl acetate 

Relevant articles and documents

Enantioselective [3 + 2] annulation of 4-isothiocyanato pyrazolones and alkynyl ketones under organocatalysis

An asymmetric [3 + 2] annulation reaction of 4-isothiocyanato pyrazolones with alkynyl ketones in the presence of an organic catalyst derived from a cinchona alkaloid under mild conditions is realized. This protocol provides unprecedented expeditious access to a wide range of optically active spiro[pyrroline-pyrazolones] with various electronic properties in high yields with good to excellent enantioselectivities.

C-F bond cleavage enabled redox-neutral [4+1] annulation via C-H bond activation

Using α,α-difluoromethylene alkyne as a nontraditional one-carbon reaction partner, a synthetically novel method for the construction of isoindolin-1-one derivatives via Rh(III)-catalyzed [4+1] annulation reaction is reported. The 2-fold C-F bond cleavage not only enables the generation of desired product under an overall oxidant-free condition but also results in a net migration of carbon-carbon triple bond. In addition, the present reaction protocol exhibits a tolerance of a wide spectrum of functional groups due to the mild reaction conditions employed.

Catalytic Nucleophilic Fluorination of Secondary and Tertiary Propargylic Electrophiles with a Copper-N-Heterocyclic Carbene Complex

A catalytic method for the nucleophilic fluorination of propargylic electrophiles is described. Our protocol involves the use of a Cu(NHC) complex as the catalyst and is suitable for the preparation of secondary and tertiary propargylic fluorides without