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(rac)-3-phenyl-1,2,3,4-tetrahydroquinoline is a chemical compound belonging to the class of tetrahydroquinolines. It is a racemic mixture, containing equal amounts of both enantiomers. (rac)-3-phenyl-1,2,3,4-tetrahydroquinoline has been studied for its potential biological activities and its role as a drug target for various diseases. Its structure and properties make it an interesting subject for research in chemistry, pharmacology, and materials science.

78317-98-3

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78317-98-3 Usage

Uses

Used in Pharmaceutical Development:
(rac)-3-phenyl-1,2,3,4-tetrahydroquinoline is used as a potential drug target for the development of new pharmaceuticals, due to its potential biological activities and its role in targeting various diseases.
Used in Chemical Research:
(rac)-3-phenyl-1,2,3,4-tetrahydroquinoline is used as a subject of study in the field of chemistry, where its structure and properties are investigated for potential applications and insights into the behavior of similar compounds.
Used in Materials Science:
(rac)-3-phenyl-1,2,3,4-tetrahydroquinoline is also used in materials science research, where its unique properties may contribute to the development of new materials with specific characteristics or functions.

Check Digit Verification of cas no

The CAS Registry Mumber 78317-98-3 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,8,3,1 and 7 respectively; the second part has 2 digits, 9 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 78317-98:
(7*7)+(6*8)+(5*3)+(4*1)+(3*7)+(2*9)+(1*8)=163
163 % 10 = 3
So 78317-98-3 is a valid CAS Registry Number.

78317-98-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name (rac)-3-phenyl-1,2,3,4-tetrahydroquinoline

1.2 Other means of identification

Product number -
Other names 3(R,S)-phenyl-1,2,3,4-tetrahydroquinoline

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:78317-98-3 SDS

78317-98-3Relevant academic research and scientific papers

Method for preparing tetrahydroquinoline compounds by catalytic hydrogenation of ruthenium catalyst

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Paragraph 0042-0045, (2021/01/29)

The invention relates to a method for preparing tetrahydroquinoline compounds by catalytic hydrogenation of a ruthenium catalyst, which comprises the following steps: by using p-cymene ruthenium chloride dimer as a catalyst and hydrogen as a reducing agent, mixing the p-cymene ruthenium chloride dimer, phosphine ligand and quinoline compounds, and dissolving the mixture in an organic solvent to react, and carrying out post-treatment to obtain the tetrahydroquinoline derivative. Compared with the prior art, the method has the advantages of easily available raw materials, mild conditions, simpleoperation, atom economy, simple and green synthesis process, mild reaction conditions, excellent selectivity, high yield and good reaction universality, and has a wide application value in fine chemical intermediate synthesis.

Silver-Catalyzed Reduction of Quinolines in Water

Wang, Yan,Dong, Baobiao,Wang, Zikun,Cong, Xuefeng,Bi, Xihe

supporting information, p. 3631 - 3634 (2019/05/24)

A ligand- and base-free silver-catalyzed reduction of quinolines and electron-deficient aromatic N-heteroarenes in water has been described. Mechanistic studies revealed that the effective reducing species was Ag-H. This versatile catalytic protocol provided facile, environmentally friendly, and practical access to a variety of 1,2,3,4-tetrahydroquinoline derivatives at room temperature.

Versatile (Pentamethylcyclopentadienyl)rhodium-2,2′-Bipyridine (Cp?Rh-bpy) Catalyst for Transfer Hydrogenation of N-Heterocycles in Water

Zhang, Lingjuan,Qiu, Ruiying,Xue, Xiao,Pan, Yixiao,Xu, Conghui,Li, Huanrong,Xu, Lijin

supporting information, p. 3529 - 3537 (2016/01/25)

An investigation employing the catalytic system consisting of (pentamethylcyclopentadienyl)rhodium dichloride dimer [Cp?RhCl2]2 and 2,2′-bipyridine (bpy) for transfer hydrogenation of a variety of quinoxalines, quinoxalinones, quinolines and indoles under aqueous conditions with formate as the hydrogen source is reported. This approach provides various tetrahydroquinoxalines, dihydroquinoxalinones, tetrahydroquinolines and indolines in good to excellent yields. The activity of the catalyst towards quinoxalines and quinoxalinones is excellent, with a substrate to catalyst ratio (S/C) of 10000 being feasible. The choice of ligand is critical to the catalysis, and the aqueous phase reduction is shown to be highly pH-dependent, with acidic pH values needed for optimal reduction. The catalyst is easy to access, and the reaction is operationally simple without requiring an inert atmosphere.

Highly enantioselective hydrogenation of quinolines using phosphine-free chiral cationic Ruthenium catalysts: Scope, mechanism, and origin of enantioselectivity

Wang, Tianli,Zhuo, Lian-Gang,Li, Zhiwei,Chen, Fei,Ding, Ziyuan,He, Yanmei,Fan, Qing-Hua,Xiang, Junfeng,Yu, Zhi-Xiang,Chan, Albert S. C.

supporting information; experimental part, p. 9878 - 9891 (2011/08/10)

Asymmetric hydrogenation of quinolines catalyzed by chiral cationic η6-arene-N-tosylethylenediamine-Ru(II) complexes have been investigated. A wide range of quinoline derivatives, including 2-alkylquinolines, 2-arylquinolines, and 2-functionalized and 2,3-disubstituted quinoline derivatives, were efficiently hydrogenated to give 1,2,3,4-tetrahydroquinolines with up to >99% ee and full conversions. This catalytic protocol is applicable to the gram-scale synthesis of some biologically active tetrahydroquinolines, such as (-)-angustureine, and 6-fluoro-2-methyl-1,2,3,4-tetrahydroquinoline, a key intermediate for the preparation of the antibacterial agent (S)-flumequine. The catalytic pathway of this reaction has been investigated in detail using a combination of stoichiometric reaction, intermediate characterization, and isotope labeling patterns. The evidence obtained from these experiments revealed that quinoline is reduced via an ionic and cascade reaction pathway, including 1,4-hydride addition, isomerization, and 1,2-hydride addition, and hydrogen addition undergoes a stepwise H+/H- transfer process outside the coordination sphere rather than a concerted mechanism. In addition, DFT calculations indicate that the enantioselectivity originates from the CH/π attraction between the η6-arene ligand in the Ru-complex and the fused phenyl ring of dihydroquinoline via a 10-membered ring transition state with the participation of TfO- anion.

Metal-free Br?nsted acid catalyzed transfer hydrogenation - New organocatalytic reduction of quinolines

Rueping, Magnus,Theissmann, Thomas,Antonchick, Andrey P.

, p. 1071 - 1074 (2007/10/03)

The first metal-free Br?nsted acid catalyzed hydrogenation of quinolines using Hantzsch dihydropyridine as the hydrogen source has been developed. This, so far unprecedented organocatalytic reduction of heteroaromatic compounds provides a variety of differently substituted 1,2,3,4-tetrahydroquinolines in excellent yields under mild reaction conditions using a remarkably low amount of Br?nsted acid catalyst. Georg Thieme Verlag Stuttgart.

Convenient synthesis of 1,2,3,4-tetrahydroquinolines via direct intramolecular reductive ring closure

Chen, Wuhong,Liu, Bo,Yang, Chunhao,Xie, Yuyuan

, p. 7191 - 7193 (2007/10/03)

A simple and convenient procedure for the synthesis of 3-aryl-1,2,3,4-tetrahydroquinolines is reported. 3-Aryl-1,2,3,4-tetrahydroquinolines are directly obtained by reductive ring closure of 2-phenyl-3-(2-nitrophenyl)-propionitrile derivatives in moderate to high yields.

Chemotherapeutic agents

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, (2008/06/13)

A method of treating or preventing viral infections, in particular rhinovirus infections comprising the administration of an effective amount of a 2-phenyltetralin derivative or a heterocyclic analogue thereof. Pharmaceutical compositions containing these compounds, and some novel compounds are also disclosed.

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