13505-39-0

Basic information

• Product Name: β-Hydroxybutyrophenone
• Synonyms: 1-Benzoyl-2-propanol;β-Hydroxybutyrophenone
• CAS NO: 13505-39-0
• Molecular Formula: C₁₀H₁₂O₂
• Molecular Weight: 164.2
• Mol File: 13505-39-0.mol

Chemical Properties

• Boiling Point: 150-152 °C(Press: 12 Torr)
• Appearance: /
• Density: 1.081±0.06 g/cm3(Predicted)
• PKA: 14.43±0.20(Predicted)
• CAS DataBase Reference: β-Hydroxybutyrophenone(CAS DataBase Reference)
• NIST Chemistry Reference: β-Hydroxybutyrophenone(13505-39-0)
• EPA Substance Registry System: β-Hydroxybutyrophenone(13505-39-0)

Safety Data

• Hazardous Substances Data: 13505-39-0(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
β-Hydroxybutyrophenone is used as an intermediate in the production of pharmaceuticals for its versatile chemical properties, contributing to the synthesis of various drug compounds.
Used in Fragrance Industry:
β-Hydroxybutyrophenone is used as a component in the creation of fragrances, leveraging its aromatic characteristics to enhance or modify scents in perfumes and other scented products.
Used in Research and Development:
β-Hydroxybutyrophenone is used as a psychotropic agent in research, where it has shown antidepressant and anxiolytic properties in some animal studies, indicating potential for further exploration in the field of mental health treatments.
Used in Asymmetric Synthesis:
β-Hydroxybutyrophenone is used as a chiral auxiliary in asymmetric synthesis, a technique crucial for producing enantiomerically pure compounds, which is essential in many areas of chemistry, including pharmaceuticals and agrochemicals.

Upstream product

• 614-20-0 3-oxo-3-phenylpropionic acid 
• 75-07-0 acetaldehyde 
• 98-86-2 acetophenone 
• 93-91-4 1-phenylbutan-1,3-dione 
• 65469-88-7 1-phenylbutane-1,3-diol 
• 70-11-1 α-bromoacetophenone 
• 141277-73-8 4-chloro-3-hydroxy-1-phenyl-1-butanone 
• 1896-62-4 (E)-benzalacetone 
• 17180-62-0 (3-methyloxiran-2-yl)(phenyl)methanone 
• 141-75-3 butyryl chloride 
• 108-95-2 phenol 
• 7446-70-0 aluminium trichloride 
• 4346-18-3 phenyl butanoate 
• 97395-17-0 3,5-Dihydroxy-3,6,6-trimethyl-5-phenyl-1,2-dioxan 

Downstream Products

• 495-41-0 1-phenylbut-2-en-1-one 
• 76926-84-6 (+/-)-3-acetoxy-1-phenylbutan-1-one 
• 431-03-8 dimethylglyoxal 
• 105735-20-4 (3S)-(+)-3-hydroxy-1-phenylbutan-1-one 
• 116660-74-3 (-)-(3R)-3-hydroxy-1-phenylbutan-1-one 
• 578020-31-2 (3R)-3-hydroxy-1-phenylbutan-1-one acetate 
• 93-91-4 1-phenylbutan-1,3-dione 
• 34880-85-8 3-chloro-1-phenylbutan-1-one 
• 123660-24-2 (+/-)-1,1-diphenyl-1,3-butanediol 
• 1286722-86-8 C₂₀H₁₉F₃O₄ 
• 122968-91-6 (E,3RS,1'SR)-3-(1'-hydroxy-1'phenyl-2'-butenyl)-1-methyl-2-pyrrolidinone 
• 122968-92-7 (E,3RS,1'SR)-3-(1'-hydroxy-1'-phenyl-2'-butenyl)-1-methyl-2-pyrrolidinone 
• 122969-97-5 (2'RS,3'SR)-1-(2',3'-dimethyl-1',5'-dioxo-5'-phenylpentyl)pyrrolidine 
• 122968-58-5 (2'RS,3'RS)-1-(2',3'-dimethyl-1',5'-dioxo-5'-phenylpentyl)pyrrolidine 

Relevant articles and documents

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Chromium(III)-Catalyzed Addition of Water and Alcohol to α,β-Unsaturated Ketones for the Synthesis of β-Hydroxyl and β-Alkoxyl Ketones in Aqueous Media

An efficient chromium(III) chloride-catalyzed Michael-type reaction of water or alcohol with α,β-unsaturated ketones is developed. A variety of α,β-unsaturated ketones effectively reacted with either water or alcohols to give the corresponding β-hydroxyl ketones or β-alkoxyl ketones in modest to high yields with excellent compatibility to various functional groups. The approach was further utilized for the preparation of synthetically useful compounds containing tetrahydrofuran skeleton.

Indium(III)-Catalyzed Hydration and Hydroalkoxylation of α,β-Unsaturated Ketones in Aqueous Media

The hydration of α,β-unsaturated ketones with water proceeded efficiently in the presence of In(OTf)3 (20 mol%) in aqueous media to afford synthetically versatile β-hydroxyketones in moderate to good yields with good functional group compatibility. The method also can be extended to the hydroalkoxylation of α,β-unsaturated ketones with various alcohols for the efficient synthesis of β-alkoxyketones as well as tetrahydrofuran derivatives. (Figure presented.).

Photocatalysis with Quantum Dots and Visible Light: Selective and Efficient Oxidation of Alcohols to Carbonyl Compounds through a Radical Relay Process in Water

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