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Isoxazole, 5-(2-furanyl)-3-phenyl-, is a heterocyclic organic compound characterized by a five-membered isoxazole ring fused with a benzene ring. Isoxazole, 5-(2-furanyl)-3-phenyl- features a furan ring attached to the isoxazole at the 5-position and a phenyl group at the 3-position. It is a colorless solid with a molecular formula of C12H7NO2 and a molecular weight of 197.19 g/mol. The compound is known for its potential applications in the synthesis of various pharmaceuticals and agrochemicals due to its unique structure and reactivity. It is typically synthesized through various chemical reactions, such as condensation or cycloaddition, and can be further functionalized to create a range of derivatives with diverse properties and applications.

2976-13-8

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2976-13-8 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 2976-13-8 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 2,9,7 and 6 respectively; the second part has 2 digits, 1 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 2976-13:
(6*2)+(5*9)+(4*7)+(3*6)+(2*1)+(1*3)=108
108 % 10 = 8
So 2976-13-8 is a valid CAS Registry Number.

2976-13-8SDS

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 5-(2′-furyl)-3-phenylisoxazole

1.2 Other means of identification

Product number -
Other names -

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

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More Details:2976-13-8 SDS

2976-13-8Relevant academic research and scientific papers

Synthesis of isoxazoles via cyclization of β-fluoro enones with sodium azide

Li, Liangkui,Huang, Shiqing,Mao, Kuantao,Lv, Leiyang,Li, Zhiping

, (2021/04/22)

A practical method for the synthesis of 3,5-disubstituted isoxazoles via cyclization of β-fluoro enones with sodium azide was disclosed. Density functional theory (DFT) calculation indicated that both (1) the azirine formation followed by intramolecular rearrangement and (2) direct enolate O-attack via 5-exo-trig cyclization of vinyl azide were possible for the isoxazole formation.

General Platform for the Conversion of Isoxazol-5-ones to 3,5-Disubstituted Isoxazoles via Nucleophilic Substitutions and Palladium Catalyzed Cross-Coupling Strategies

Fernandes, Alessandra A. G.,da Silva, Amanda F.,Okada, Celso Y.,Suzukawa, Vitor,Cormanich, Rodrigo A.,Jurberg, Igor D.

, p. 3022 - 3034 (2019/05/17)

A general platform for the conversion of isoxazol-5-ones to 3,5-disubstituted isoxazoles has been developed via a two-step strategy. The first step leads to the formation of 5-(pseudo)halogenated isoxazoles, while in the second, a variety of heteroalkyl-, heteroaryl-, alkyl-, alkenyl-, alkynyl- and aryl-chains can be installed via nucleophilic substitutions or palladium catalyzed cross-coupling reactions.

One-pot three-component synthesis of 3,5-disubstituted isoxazoles by a coupling-cyclocondensation sequence

Liu, Hai-Ling,Geng, Zhu-Feng,Zhang, Si-Yu,Han, Jie

, p. 1221 - 1227 (2014/05/20)

A convenient one-pot procedure for the synthesis of 3,5-disubstituted isoxazoles from acid chloride, terminal alkyne, and hydroxylamine hydrochloride catalyzed by Pd(PPh3)2Cl2/CuI has been developed. The coupling of acid c

Preparation of 3,5-disubstituted pyrazoles and isoxazoles from terminal alkynes, aldehydes, hydrazines, and hydroxylamine

Harigae, Ryo,Moriyama, Katsuhiko,Togo, Hideo

, p. 2049 - 2058 (2014/04/03)

The reaction of terminal alkynes with n-BuLi, and then with aldehydes, followed by the treatment with molecular iodine, and subsequently hydrazines or hydroxylamine provided the corresponding 3,5-disubstituted pyrazoles or isoxazoles in good yields with high regioselectivity, through the formations of propargyl secondary alkoxides and α-alkynyl ketones. The present reactions are one-pot preparation of 3,5-disubstituted pyrazoles from terminal alkynes, aldehydes, molecular iodine, and hydrazines, and 3,5-disubstituted isoxazoles from terminal alkynes, aldehydes, molecular iodine, and hydroxylamine.

Synthesis of 3-Substituted 5-Arylisoxazoles from α,β-Unsaturated Oximes

Alberola, Angel,Banez, J. Manuel,Calvo, Luis,Rodriguez, M. Teresa Rodriguez,Sanudo, M. Carmen

, p. 467 - 471 (2007/10/02)

The synthesis of 3-substituted 5-arylisoxazoles from oximes of α,β-unsaturated ketones is studied. The formation of the isoxazole derivatives takes place by cyclization of oximes in the presence of iodine and potassium iodide. The presence of isoxazoline

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