112665-41-5

Basic information

• Product Name: ETHYL 7-OXO-7-PHENYLHEPTANOATE
• Synonyms: ETHYL 7-OXO-7-PHENYLHEPTANOATE;7-Oxo-7-phenyl-heptanoic acid ethyl ester
• CAS NO: 112665-41-5
• Molecular Formula: C₁₅H₂₀O₃
• Molecular Weight: 248.32
• Mol File: 112665-41-5.mol
• Article Data: 6

Chemical Properties

• Boiling Point: 353.736°C at 760 mmHg
• Flash Point: 153.394°C
• Appearance: /
• Density: 1.034
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.499
• Storage Temp.: 2-8°C
• CAS DataBase Reference: ETHYL 7-OXO-7-PHENYLHEPTANOATE(CAS DataBase Reference)
• NIST Chemistry Reference: ETHYL 7-OXO-7-PHENYLHEPTANOATE(112665-41-5)
• EPA Substance Registry System: ETHYL 7-OXO-7-PHENYLHEPTANOATE(112665-41-5)

Safety Data

• Hazardous Substances Data: 112665-41-5(Hazardous Substances Data)

Usage

General Description

Ethyl 7-oxo-7-phenylheptanoate is an organic compound that belongs to the ester functional group. It is a clear, colorless liquid with a fruity, sweet aroma, and is commonly used as a flavor and fragrance ingredient in the food and beverage industry. It is also used in the production of perfumes and cosmetics. The chemical is synthesized by the esterification of 7-oxo-7-phenylheptanoic acid with ethanol, and it is considered a safe compound when used in approved concentrations for its intended purposes. However, it should be handled and stored with care, as it may be irritating to the eyes and skin, and should not be ingested or inhaled. Overall, ethyl 7-oxo-7-phenylheptanoate is a versatile chemical with a wide range of applications in various industries.

InChI:InChI=1/C15H20O3/c1-2-18-15(17)12-8-4-7-11-14(16)13-9-5-3-6-10-13/h3,5-6,9-10H,2,4,7-8,11-12H2,1H3

Upstream product

• 14794-32-2 ethyl 6-(chloroformyl)hexanoate 
• 71-43-2 benzene 
• 13159-24-5 ethyl 6-iodohexanoate 
• 98-88-4 benzoyl chloride 
• 29823-18-5 ethyl 7-bromoheptanoate 
• 64-17-5 ethanol 
• 3580-38-9 2-Benzoylcyclohexanone 
• 98-86-2 acetophenone 
• 141-52-6 sodium ethanolate 
• 33018-91-6 7-ethoxy-7-oxoheptanoic acid 

Downstream Products

• 112665-42-6 7-hydroxy-7-phenyl-heptanoic acid ethyl ester 
• 3580-38-9 2-Benzoylcyclohexanone 
• 7472-43-7 6-benzoylhexanoic acid 
• 250601-77-5 ethyl (E)-7-{4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]benzyloxyimino}-7-phenylheptanoate 
• 5771-68-6 7-phenyl-6-heptenoic acid 
• 103186-19-2 (-)-AA 2414 
• 103187-09-3 (+)-AA 2414 
• 112665-43-7 seratrodast 
• 112665-40-4 p-nitrophenyl 7-(3,5,6-trimethyl-1,4-benzoquinon-2-yl)-7-phenylheptanoate 
• 103186-54-5 7-(3-Methyl-1,4-naphthoquinon-2-yl)-7-phenyl-heptanoic acid 
• 148989-73-5 7-(2,5-Dihydroxy-3,4,6-trimethyl-phenyl)-7-phenyl-heptanoic acid 
• 103187-18-4 7-hydroxy-7-phenylheptanoic acid 
• 92655-06-6 7-Phenyl-hept-6-ensaeure-ethylester 

Relevant articles and documents

Synthesis of β-hydroxy esters using highly active manganese

A modified Reformatsky reaction is reported using highly reactive manganese (Mn*). The active manganese was found to readily react with α-haloester in the presence of aldehydes and ketones to yield the corresponding β-hydroxy esters. The reaction is carried out at room temperature in the absence of Lewis acid or trapping agents.

Indium-catalyzed synthesis of keto esters from cyclic 1,3-diketones and alcohols and application to the synthesis of seratrodast

Esterification reactions from cyclic 1,3-diketones and alcohols are carried out in the presence of several Lewis acids. In particular, indium(III) triflate, In(OTf)3, iron(III) triflate, Fe-(OTf)3, copper(II) triflate, Cu(OTf)2, and silver(I) triflate, AgOTf, show high catalytic activities. These reactions proceed through the carbon-carbon bond cleavage by a retro-aldol reaction and were found to be highly regioselective even in the presence of other functional groups. This type of reaction can also be applied to the preparation of the keto esters during the synthesis of seratrodast, which is an antiasthmatic and eicosanoid antagonist.

Structurally simple trichostatin A-like straight chain hydroxamates as potent histone deacetylase inhibitors

A series of new, structurally simple trichostatin A (TSA)-like straight chain hydroxamates were prepared and evaluated for their ability to inhibit partially purified human histone deacetylase 1 (HDAC-1). Some of these compounds such as 8m, 8n, 12, and 15