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Diphenyl-acetic acid ethyl ester, also known as ethyl diphenylacetate, is a colorless to light yellow liquid with a fruity odor. It is insoluble in water but soluble in organic solvents. This chemical compound is commonly used in the pharmaceutical industry and organic synthesis. Its structure and reactivity make it a versatile building block in the synthesis of various organic compounds, particularly in the production of pharmaceutical intermediates. Diphenyl-acetic acid ethyl ester has been studied for its potential anti-inflammatory and analgesic properties, making it a promising candidate for the development of novel drugs.

3468-99-3

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3468-99-3 Usage

Uses

Used in Pharmaceutical Industry:
Diphenyl-acetic acid ethyl ester is used as a building block for the synthesis of various pharmaceutical intermediates. Its structure and reactivity make it an important component in the development of new drugs.
Used in Organic Synthesis:
Diphenyl-acetic acid ethyl ester is used as a versatile chemical in organic synthesis, contributing to the production of a wide range of organic compounds.
Used in Drug Development:
Diphenyl-acetic acid ethyl ester is used as a potential candidate for the development of novel drugs due to its potential anti-inflammatory and analgesic properties. Its study and application in this area could lead to the creation of new treatments for various conditions.

Check Digit Verification of cas no

The CAS Registry Mumber 3468-99-3 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 3,4,6 and 8 respectively; the second part has 2 digits, 9 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 3468-99:
(6*3)+(5*4)+(4*6)+(3*8)+(2*9)+(1*9)=113
113 % 10 = 3
So 3468-99-3 is a valid CAS Registry Number.
InChI:InChI=1/C16H16O2/c1-2-18-16(17)15(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12,15H,2H2,1H3

3468-99-3SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name ethyl 2,2-diphenylacetate

1.2 Other means of identification

Product number -
Other names Acetic acid,diphenyl-,ethyl ester

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:3468-99-3 SDS

3468-99-3Relevant academic research and scientific papers

Concave pyridines for selective acylations of polyols

Luening, Ulrich,Petersen, Soenke,Schyja, Wolfgang,Hacker, Wolfgang,Marquardt, Torsten,Wagner, Kerstin,Bolte, Michael

, p. 1077 - 1084 (1998)

Selectivity enhancements in the base-catalyzed acylation of polyols (1,2- or 1,3-alkanediol, partially protected glucoside) have been found with (bi)macrocyclic pyridines 2 and 9 as catalysts. The different selectivities obtained for concave pyridines of varying ring sizes (1 vs. 2) are probably caused by their different geometries as a number of X-ray analyses (1a, 1b, 2a, 2b, 2e, 9) indicate. The methyl glucoside 7 can selectively be acylated in 2-position.

Br?nsted acid-catalyzed Friedel-Crafts-type alkylation of arenes with α-aryl diazoacetates

Chen, Wenming,Chen, Guifang,Wang, Biao,Wang, Wei,Huang, Wei,Tian, Xu

supporting information, (2021/01/25)

An efficient Br?nsted acid-catalyzed Friedel-Crafts-type alkylation of arenes with α-aryl diazoacetates has been developed. This protocol enables effective access to various highly functionalized diarylmethane derivatives in moderate to high yields. Moreo

Photoredox Catalytic Phosphite-Mediated Deoxygenation of α-Diketones Enables Wolff Rearrangement and Staudinger Synthesis of β-Lactams

Jiang, Zhiyong,Li, Haijun,Wei, Guo,Yang, Hui

supporting information, p. 19696 - 19700 (2021/08/03)

A novel visible-light-driven catalytic activation of C=O bonds by exploiting the photoredox chemistry of 1,3,2-dioxaphospholes, readily accessible from α-diketones and trialkyl phosphites, is reported. This mild and environmentally friendly strategy provides an unprecedented and efficient access to the Wolff rearrangement reaction which traditionally entails α-diazoketones as precursors. The resulting ketenes could be precisely trapped by alcohols/thiols to give α-aryl (thio)acetates and by imines to afford the valuable β-lactams in up to 99 % yields.

Deoxygenative α-alkylation and α-arylation of 1,2-dicarbonyls

Arman, Hadi D.,Dang, Hang T.,Haug, Graham C.,Jin, Shengfei,Larionov, Oleg V.,Nguyen, Viet D.

, p. 9101 - 9108 (2020/09/17)

Construction of C-C bonds at the α-carbon is a challenging but synthetically indispensable approach to α-branched carbonyl motifs that are widely represented among drugs, natural products, and synthetic intermediates. Here, we describe a simple approach to generation of boron enolates in the absence of strong bases that allows for introduction of both α-alkyl and α-aryl groups in a reaction of readily accessible 1,2-dicarbonyls and organoboranes. Obviation of unselective, strongly basic and nucleophilic reagents permits carrying out the reaction in the presence of electrophiles that intercept the intermediate boron enolates, resulting in two new α-C-C bonds in a tricomponent process. This journal is

Diaryl acetate compound and preparation method thereof

-

Paragraph 0019-0022, (2020/04/29)

The invention provides a diaryl acetate compound and a preparation method, and the preparation method comprises the following steps: (1) adding a diary 1, 2-diketone compound, an alcohol compound, trialkyl phosphite and a photocatalyst into a reaction vessel, adding a solvent, and dissolving to obtain a reaction solution; (2) irradiating an reaction liquid by using a light source and stirring until the reaction is complete; and (3) after the reaction is finished, recovering the solvent under reduced pressure and purifying by column chromatography to obtain the diaryl acetate compound. Startingfrom easily available diaryl 1, 2-diketone, the method has the advantages of mild and green reaction conditions, no need of precious transition metal catalysis, economical performance, environmentalprotection, and high practicality.

Catalytic C-C coupling of diazo compounds with arylboronic acids: Using surface modified sewage sludge as catalyst

Huang, Fei,Huang, He,Hughes, Timothy,Xie, Yuxing,Xu, Jun,Yu, Yang,Zhang, Zhipeng

supporting information, p. 4165 - 4173 (2020/07/14)

A green, mild and efficient synthesis of diarylmethines using sewage sludge-derived carbonaceous materials (SW) by perchloric acid catalyzed coupling reactions between diazo compounds and arylboronic acids was developed. The reaction shows a high level of functional tolerance and a broad substrate scope. Furthermore, the highly selective 1,2-alkyl shift products were furnished through the sterically demanding R4, R5 migration of diazo compounds (3-diazochromanone). The structures of 1,2-shift products have been further confirmed by single-crystal X-ray analysis. Significantly, the synthesis of the core structures of darifenacin (a clinical drug for overactive bladder syndrome, OAB) and diclofensine (a stimulant drug showing antidepressant and monoamine reuptake inhibitor activity) further demonstrated the efficacy and synthetic potential of this method. This journal is

Method for synthesizing aryl acetate derivative under catalysis of surface modified sludge charcoal

-

Paragraph 0043-0058, (2019/11/12)

The invention discloses a method for synthesizing an aryl acetate derivative under the catalysis of surface modified sludge charcoal. According to the method, the construction of a C-C bond is realized by an arylation reaction realized by taking the surfa

Iodobenzene Dichloride in the Esterification and Amidation of Carboxylic Acids: In-Situ Synthesis of Ph3PCl2

Carle, Myriam S.,Shimokura, Grace K.,Murphy, Graham K.

, p. 3930 - 3933 (2016/08/24)

A novel, in-situ synthesis of dichlorotriphenylphosphorane (Ph3PCl2) is accomplished upon combining PPh3and the easily prepared hypervalent iodine reagent iodobenzene dichloride (PhICl2). The phosphorane is selectively generated in the presence of carboxylic acid or alcohol residues to rapidly produce acyl chlorides and alkyl chlorides in high yields. Addition of EtOH, PhOH, BnOH, Et2NH or CH2N2results in the direct synthesis of esters, amides and diazo ketones from carboxylic acids.

Synthesis & characterization of 2-(substituted-phenyl)acetohydrazide analogs, 1,3,4-oxadiazoles, and 1,2,4-triazine Ring Systems: A novel class of potential analgesic and anti-inflammatory agents

Nayak, Prakash S.,Narayana, Badiadka,Fernandes, Jennifer,Sarojini, Balladka K.,Sheik, Sana,Shashidhara, Kenkere S.,Chandrashekhar, Konambi R.,Byrappa, Kullaiah

, p. 547 - 562 (2016/10/12)

The new series of 2-(substituted-phenyl)acetohydrazides analogs, S-alkylated 5-substituted-1,3,4-oxadiazoles-2-thione derivatives and 5-arylidene-3-substituted-1,2,4-triazines have been synthesized in good yields and characterized by IR, NMR, mass spectral and elemental analyses. All the synthesized compounds 4(a-d), 5(a-d), 7(a-b), and 8(a-f) are evaluated for their in vitro DPPH scavenging, antimicrobial activity, in vivo analgesic, anti-inflammatory activities. The results of the anti-inflammatory activity are supported by molecular docking study with mouse COX-1 (PDB ID: 2CZT) and COX-2 (PDB ID: 3LN1) enzymes to predict their putative interactions. Among all the assays conducted, the compounds 5-(4-bromophenyl)-3-(naphthalen-2-ylmethyl)-1,2,4-triazine (4d) and2-{[5-(diphenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(pyrazin-2-yl)acetamide (8a) have emerged as the most potent molecules.

RhI-Catalyzed Stille-Type Coupling of Diazoesters with Aryl Trimethylstannanes

Liu, Zhen,Xia, Ying,Feng, Sheng,Wang, Shuai,Qiu, Di,Zhang, Yan,Wang, Jianbo

, p. 1379 - 1384 (2015/09/15)

A RhI-catalyzed cross-coupling of diazoester with arylstannane was developed. This reaction represents the first Stille-type coupling that uses a diazo compound as the coupling partner. The reaction is operationally simple and can be carried out under mild conditions, thus providing an alternative approach for the synthesis of α-aryl esters. RhI-carbene migratory insertion process is suggested to be involved as the key step in this Stille-type coupling.

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