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3-Butynoic acid, 2-oxo-4-phenyl-, ethyl ester is a chemical compound with the molecular formula C12H10O3. It is an ester derivative of 2-oxo-4-phenylbutynoic acid, where the carboxylic acid group is esterified with ethanol. This organic compound is characterized by the presence of a triple bond (acetylene) in the butynoic acid chain, a carbonyl group (keto) adjacent to the triple bond, and a phenyl ring attached to the carbonyl group. The ethyl ester group is attached to the carboxylic acid, making it a derivative of the parent acid. 3-Butynoic acid, 2-oxo-4-phenyl-, ethyl ester is known for its potential applications in the synthesis of various pharmaceuticals and agrochemicals, as well as in the preparation of specialty chemicals. It is an example of a functional group-rich molecule, which can be further modified or used as a building block in organic synthesis.

1619-73-4

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1619-73-4 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 1619-73-4 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 1,6,1 and 9 respectively; the second part has 2 digits, 7 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 1619-73:
(6*1)+(5*6)+(4*1)+(3*9)+(2*7)+(1*3)=84
84 % 10 = 4
So 1619-73-4 is a valid CAS Registry Number.

1619-73-4SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name ethyl 2-oxo-4-phenylbut-3-ynoate

1.2 Other means of identification

Product number -
Other names ethyl 4-phenyl-2-oxobut-3-ynoate

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 -
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More Details:1619-73-4 SDS

1619-73-4Relevant academic research and scientific papers

A simple and efficient method for mild and selective oxidation of propargylic alcohols using TEMPO and calcium hypochlorite

Reddy, Sabbasani Rajasekhara,Chadha, Anju

, p. 14929 - 14933 (2013)

Oxidation of propargylic alcohols to the corresponding aldehydes and ketones was achieved at room temperature using 2,2,6,6-tetramethylpiperidine-1- oxyl (TEMPO) and calcium hypochlorite (Ca(OCl)2). Propargylic diols yielded corresponding dialdehydes as the product. This system was found to be very efficient for both the electron donating and electron withdrawing groups such as methoxy and nitro substituted alcohols, respectively. This method does not require any additives and demonstrates the controlled, selective oxidation of propargylic alcohols affording up to 97% isolated yield. The Royal Society of Chemistry 2013.

Chiral Phosphoric Acid-Catalyzed Enantioselective Synthesis of Pyrazole-Based Unnatural α-Amino Acid Derivatives

Woldegiorgis, Alemayehu Gashaw,Han, Zhao,Lin, Xufeng

supporting information, p. 274 - 280 (2021/11/01)

An enantioselective synthesis of unnatural pyrazole-based α-chiral amino acid derivatives from the asymmetric reaction of N-aryl-5-aminopyrazoles with β,γ-alkynyl-α-imino esters using a chiral spirocyclic phosphoric acid catalyst was developed. Using the established methodology, various pyrazole-based α-amino acid derivatives with tetrasubstituted carbon stereocenters were obtained in 67–98% yields and with 73–99% enantioselectivities. The NH2 functionality in the corresponding products enables further transformations to a chiral thiourea and a lactam. (Figure presented.).

Organocatalytic Asymmetric Dearomatization Reaction for the Synthesis of Axial Chiral Allene-Derived Naphthalenones Bearing Quaternary Stereocenters

Woldegiorgis, Alemayehu Gashaw,Han, Zhao,Lin, Xufeng

, p. 6606 - 6611 (2021/09/02)

The highly regio-, diastereo-, and enantioselective dearomatization reaction of 1-substituted 2-naphthols and β,γ-alkynyl-α-imino esters with complete atom economy is disclosed via chiral phosphoric acid catalysis. This protocol provides facile and effici

Organocatalytic Enantioselective Synthesis of Tetrasubstituted α-Amino Allenoates by Dearomative γ-Addition of 2,3-Disubstituted Indoles to β,γ-Alkynyl-α-imino Esters

Yang, Junxian,Wang, Zheng,He, Zeyuan,Li, Guofeng,Hong, Liang,Sun, Wangsheng,Wang, Rui

supporting information, p. 642 - 647 (2019/11/28)

The first asymmetric synthesis of tetrasubstituted α-amino allenoates by a chiral phosphoric acid catalyzed dearomative γ-addition reaction of 2,3-disubstituted indoles to β,γ-alkynyl-α-imino esters is reported. This method provides access to a series of

Activating Pyrimidines by Pre-distortion for the General Synthesis of 7-Aza-indazoles from 2-Hydrazonylpyrimidines via Intramolecular Diels-Alder Reactions

Le Fouler, Vincent,Chen, Yu,Gandon, Vincent,Bizet, Vincent,Salomé, Christophe,Fessard, Thomas,Liu, Fang,Houk,Blanchard, Nicolas

supporting information, p. 15901 - 15909 (2019/10/22)

Pyrimidines are almost unreactive partners in Diels-Alder cycloadditions with alkenes and alkynes, and only reactions under drastic conditions have previously been reported. We describe how 2-hydrazonylpyrimidines, easily obtained in two steps from commercially available 2-halopyrimidines, can be exceptionally activated by trifluoroacetylation. This allows a Diels-Alder cycloaddition under very mild reaction conditions, leading to a large diversity of aza-indazoles, a ubiquitous scaffold in medicinal chemistry. This reaction is general and scalable and has an excellent functional group tolerance. A straightforward synthesis of a key intermediate of Bayer's Vericiguat illustrates the potential of this cycloaddition strategy. Quantum mechanical calculations show how the simple N-trifluoroacetylation of 2-hydrazonylpyrimidines distorts the substrate into a transition-state-like geometry that readily undergoes the intramolecular Diels-Alder cycloaddition.

An Unprecedented Organocascade Synthesis of Functionalized Bicyclic Nitrones from 2-Aminomalonate Derived Nucleophiles and 1-Nitro-1,3-Enynes via Allenes Formation and Subsequent Rearrangement

Huang, Wan-Yun,Gurubrahamam, Ramani,Chen, Kwunmin

supporting information, p. 170 - 175 (2018/12/11)

An efficient organocatalytic cascade reaction for synthesising functionalized bicyclic nitrones is reported. The reaction of dielectrophilic ethyl 2-(nitromethylene)-4-arylbut-3-ynoate and (E)-diethyl 2-((2-hydroxybenzylidene)-amino)malonates to give a un

Synthesis of α-(4-Oxazolyl)amino Esters via Br?nsted Acid Catalyzed Tandem Reaction

Lee, Ansoo,Oh, Seohee,Kim, Hyunwoo

supporting information, p. 3319 - 3322 (2018/06/11)

A one-step, Br?nsted acid catalyzed tandem reaction for the synthesis of α-(4-oxazolyl)amino esters was developed. 4-Nitrobenzenesulfonic acid was found to be an efficient catalyst for the coupling of ethyl 2-oxobut-3-ynoates with amides to provide variou

Organocatalytic synthesis of densely functionalized oxa-bridged 2,6-epoxybenzo[: B] [1,5]oxazocine heterocycles

Gurubrahamam, Ramani,Nagaraju, Koppanathi,Chen, Kwunmin

supporting information, p. 6048 - 6051 (2018/06/18)

Metal-free addition of salicylhydrazones to electron deficient internal alkynes catalyzed by 1,4-diazabicyclo[2.2.2]octane (DABCO) to yield oxa-bridged 2,6-epoxybenzo[b][1,5]oxazocine heterocycles was achieved. The demonstrated protocol proceeds through an o-quinone methide formation, aza-Michael addition, stereoselective protonation, enamine promoted aromatization, O,O-acetalization and O,N-aminalization sequence to provide privileged heterocycles in good yields with high diastereoselectivities.

Asymmetric “Acetylenic” [3+2] Cycloaddition of Nitrones Catalyzed by Cationic Chiral PdII Lewis Acid

Honda, Kazuya,Mikami, Koichi

supporting information, p. 2838 - 2841 (2018/09/14)

Highly enantioselective [3+2] cycloaddition of ynones and nitrones has been developed. Very bulky ligand, DTBM-SEGPHOS, was used for an effective asymmetric induction over distal reaction centers on the linear ynone dipolarophile and for prevention of PdII catalyst deactivation by coordination of the nitrones. The reaction has wide scope of substrates in both ynones and nitrones.

Cationic Chiral Pd-Catalyzed “Acetylenic” Diels–Alder Reaction: Computational Analysis of Reversal in Enantioselectivity

Honda, Kazuya,Ohkura, Shun,Hayashi, Yoshihiro,Kawauchi, Susumu,Mikami, Koichi

supporting information, p. 2842 - 2846 (2018/09/25)

The highly enantioselective Diels–Alder reaction of acetylenic dienophiles is shown to be effectively catalyzed by cationic chiral palladium complexes. Not only the degree but also the sense of enantioselectivity critically depends on the steric demand of ligands. Computational analyses indicate that the steric demand does not affect the endo/exo-selectivity but the enantioface selectivity of dienes.

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