1674-37-9

Basic information

• Product Name: OCTANOPHENONE
• Synonyms: 1-phenyl-1-octanon;1-Phenyl-1-octanone;Ketone, heptyl phenyl;TIMTEC-BB SBB008388;N-HEPTYL PHENYL KETONE;N-OCTANOPHENONE;OCTANOPHENONE;CAPRYLOPHENONE
• CAS NO: 1674-37-9
• Molecular Formula: C14H20O
• Molecular Weight: 204.31
• EINECS: 216-817-2
• Product Categories: Aromatic Ketones (substituted)
• Mol File: 1674-37-9.mol
• Article Data: 95

Chemical Properties

• Melting Point: 21.5-23.5 °C(lit.)
• Boiling Point: 285-290 °C(lit.)
• Flash Point: >230 °F
• Appearance: Clear colorless to slightly yellow/Liquid
• Density: 0.936 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.00247mmHg at 25°C
• Refractive Index: n20/D 1.5044(lit.)
• Storage Temp.: 2-8°C
• Water Solubility: Soluble in hot ethanol, acetone, toluene and other common organic solvents. Insoluble in water.
• BRN: 1868534
• CAS DataBase Reference: OCTANOPHENONE(CAS DataBase Reference)
• NIST Chemistry Reference: OCTANOPHENONE(1674-37-9)
• EPA Substance Registry System: OCTANOPHENONE(1674-37-9)

Safety Data

• Safety Statements: 23-24/25
• WGK Germany: 3
• TSCA: Yes
• Hazardous Substances Data: 1674-37-9(Hazardous Substances Data)

Usage

Description

Octanophenone, also known as 2-octylphenone, is a clear colorless to slightly yellow liquid with unique chemical properties. It is an organic compound that belongs to the class of ketones and is characterized by its distinct aromatic structure. Due to its versatile chemical nature, octanophenone finds applications in various industries, particularly as a pharmaceutical intermediate.

Uses

Used in Pharmaceutical Industry:
Octanophenone is used as a pharmaceutical intermediate for the synthesis of various drugs and medications. Its unique chemical structure allows it to serve as a key building block in the development of new pharmaceutical compounds, contributing to the advancement of medical treatments and therapies.
Used in Chemical Industry:
In the chemical industry, octanophenone can be utilized as a starting material for the production of various specialty chemicals, such as fragrances, dyes, and additives. Its aromatic structure and reactivity make it a valuable component in the synthesis of these compounds, enhancing their properties and performance.
Used in Cosmetics Industry:
Octanophenone may also find applications in the cosmetics industry, where it can be used as a fragrance ingredient or additive. Its pleasant aroma and compatibility with other ingredients make it a suitable candidate for inclusion in a wide range of cosmetic products, such as perfumes, lotions, and creams.
Used in Flavor Industry:
Due to its distinctive scent, octanophenone can be employed in the flavor industry as a component in the creation of various flavors for the food and beverage sector. Its ability to impart a unique taste and aroma to products makes it a valuable addition to the flavorist's toolbox.

Synthesis Reference(s)

Chemistry Letters, 10, p. 1193, 1981The Journal of Organic Chemistry, 64, p. 3544, 1999 DOI: 10.1021/jo982317bOrganic Syntheses, Coll. Vol. 6, p. 919, 1988

InChI:InChI=1/C14H20O/c1-2-3-4-5-9-12-14(15)13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12H2,1H3

Upstream product

• 93-58-3 benzoic acid methyl ester 
• 628-71-7 1-Heptyne 
• 592-41-6 1-hexene 
• 28531-58-0 (2-oxo-2-phenylethyl)mercury chloride 
• 4282-40-0 1-Iodoheptane 
• 32818-95-4 N-benzylidene-N'-tert-butylhydrazine 
• 16538-85-5 phenylcyclooctane 
• 7287-06-1 1-phenyl-1-cyclooctanol 
• 100-52-7 benzaldehyde 
• 75958-85-9 ((Z)-1-Fluoro-oct-1-enyl)-benzene 
• 123-38-6 propionaldehyde 
• 2189-60-8 Octylbenzene 
• 1694-92-4 2-Nitrobenzenesulfonyl chloride 
• 111-25-1 1-bromo-hexane 

Downstream Products

• 855752-80-6 (+/-)-5-hydroxy-5-phenyl-dodecane 
• 102240-54-0 isonicotinic acid-(1-phenyl-octylidenehydrazide) 
• 40237-51-2 2-dimethylaminomethyl-1-phenyl-octan-1-one 
• 2189-60-8 Octylbenzene 
• 77611-70-2 phenyl n-heptyl ketone oxime 
• 101115-26-8 1-(3-nitro-phenyl)-octan-1-one 
• 23514-80-9 3-hydroxy-3-phenyl-decanoic acid 
• 94763-03-8 7-Phenyl-n-tetradecanol-⁽⁷⁾ 
• 77611-70-2 1-Phenyl-octan-1-one oxime 
• 92500-72-6 1-Phenyl-octane-1,2-dione 2-oxime 
• 592-41-6 1-hexene 
• 95605-56-4 (1R,2R)-2-Butyl-1-phenyl-cyclobutanol 
• 95605-56-4 (1R,2S)-2-Butyl-1-phenyl-cyclobutanol 
• 98-86-2 acetophenone 

Relevant articles and documents

A new synthetic protocol for the direct preparation of organomanganese reagents; organomanganese tosylates and mesylates

A new synthetic route to organomanganese sulfonate reagents has been developed. These useful reagents can be readily prepared via direct oxidative addition of highly reactive manganese to carbon-oxygen bonds of the corresponding tosylates and mesylates under mild conditions.

Highly selective aerobic oxidation of alkyl arenes and alcohols: Cobalt supported on natural hydroxyapatite nanocrystals

Cobalt was successfully immobilized on natural hydroxyapatite nanocrystals which were obtained from cow bones (Co-NHAp). The chemical, structural, and electronic properties of this nanobiocatalyst were investigated using flame atomic absorption spectroscopy (FAAS), Fourier transform infrared (FT-IR), X-ray diffraction (XRD), thermogravimetric analysis (TGA), scanning electron microscopy (SEM), and energy dispersive spectroscopy (EDS) analysis. Natural hydroxyapatite (NHAp) as the support enhanced both catalytic activity and selectivity in the liquid phase aerobic oxidation of alkyl arenes and alcohols to their corresponding carbonyl compounds. The use of air as an inexpensive oxidant, the recyclability of the Co-NHAp nanobiocatalyst without significant decrease in its catalytic activity and easy workup are some advantages of this work.

TiCl4-catalyzed indirect anti-Markovnikov hydration of alkynes: Application to the synthesis of benzo[b]furans

(Chemical Equation Presented) An efficient methodology for the indirect anti-Markovnikov hydration of unsymmetrically substituted terminal and internal alkynes is based on TiCl4-catalyzed hydroamination reactions. Its application to ortho-alkynylhaloarenes, followed by a copper-catalyzed O-arylation, provides flexible access to substituted benzo[b]furans.

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METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL

The present invention relates to: a method for converting a hydroxyl group of an alcohol; and a catalyst which makes the method possible. A method for converting a hydroxyl group of an alcohol according to the present invention is characterized by producing a compound represented by CH(R1)(R2)Nu (wherein R1, R2 and Nu are as defined below) by reacting an alcohol represented by CH(R1)(R2)OH (wherein each of R1 and R2 represents a hydrogen atom, an optionally substituted alkyl group, or the like) and a compound having an active proton, which is represented by H-Nu (wherein Nu represents a group represented by —CHX1-EWG1 or —NR3R4; X1 represents a hydrogen atom or the like; EWG1 represents an electron-withdrawing group; and each of R3 and R4 represents a hydrogen atom, an optionally substituted alkyl group, or the like), with each other in the presence of a complex of a group 7-11 metal of the periodic table and at least one solid base that is selected from the group consisting of layered double hydroxides, composite oxides and calcium hydroxide.

Metal- And additive-free C-H oxygenation of alkylarenes by visible-light photoredox catalysis

A metal- and additive-free methodology for the highly selective, photocatalyzed C-H oxygenation of alkylarenes under air to the corresponding carbonyls is presented. The process is catalyzed by an imide-acridinium that forms an extremely strong photooxidant upon visible light irradiation, which is able to activate inert alkylarenes such as toluene. Hence, this is an easy to perform, sustainable and environmentally friendly oxidation that provides valuable carbonyls from abundant, readily available compounds.