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5-Fluoro-1-tetralone is a chemical compound with the molecular formula C10H9FO. It is a fluorinated derivative of 1-tetralone, characterized by a five-membered ring structure attached to a benzene ring. The presence of a fluorine atom in its structure gives it unique reactivity that can be beneficial in various chemical reactions and syntheses, often utilized in medicinal chemistry. As a specialty chemical, it has potential applications in developing pharmaceuticals and other complex organic molecules, although it may need to be handled with care due to possible hazards associated with its use.

93742-85-9

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93742-85-9 Usage

Uses

Used in Pharmaceutical Industry:
5-Fluoro-1-tetralone is used as a building block for the synthesis of various pharmaceutical compounds, due to its unique reactivity and structural properties. It can be incorporated into the development of new drugs, potentially leading to improved therapeutic effects and reduced side effects.
Used in Organic Synthesis:
5-Fluoro-1-tetralone is used as an intermediate in the synthesis of complex organic molecules, particularly in the field of medicinal chemistry. Its fluorinated structure allows for the creation of new compounds with altered properties, which can be further explored for their potential applications in various industries.
Used in Research and Development:
5-Fluoro-1-tetralone is used as a research compound in academic and industrial laboratories, where its unique properties can be studied and utilized in the development of new chemical processes and methodologies. This can lead to advancements in the fields of chemistry, materials science, and related disciplines.

Check Digit Verification of cas no

The CAS Registry Mumber 93742-85-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,3,7,4 and 2 respectively; the second part has 2 digits, 8 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 93742-85:
(7*9)+(6*3)+(5*7)+(4*4)+(3*2)+(2*8)+(1*5)=159
159 % 10 = 9
So 93742-85-9 is a valid CAS Registry Number.
InChI:InChI=1/C10H9FO/c11-9-5-1-4-8-7(9)3-2-6-10(8)12/h1,4-5H,2-3,6H2

93742-85-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name 5-fluoro-3,4-dihydro-2H-naphthalen-1-one

1.2 Other means of identification

Product number -
Other names 5-Fluoro-1,2,3,4-tetrahydro-1-naphthalenone

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:93742-85-9 SDS

93742-85-9Relevant academic research and scientific papers

KRAS G12C INHIBITORS AND USES THEREOF

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, (2020/12/07)

The invention relates to compounds of Formula I, and pharmaceutically acceptable salts thereof, and methods of making and using the same. The compounds of the invention are effective in inhibiting KRAS protein with a G12C mutation and are suitable for use in methods of treating cancers mediated, in whole or in part, by KRAS G12C mutation.

Synthesis of Novel Pterocarpen Analogues via [3?+?2] Coupling-Elimination Cascade of α,α-Dicyanoolefins with Quinone Monoimines

Chen, Hui,Zhao, Sihan,Cheng, Shaobing,Dai, Xingjie,Xu, Xiaoying,Yuan, Weicheng,Zhang, Xiaomei

, p. 1672 - 1683 (2019/04/08)

By employing triethylamine as a catalyst, [3?+?2] coupling-elimination cascade of α,α-dicyanoolefins with quinone monoimines was realized. The reactions afforded various novel pterocarpen analogues with generally moderate yields (up to 75%). In addition, a plausible reaction mechanism was proposed.

Highly enantioselective [3+2] coupling of cyclic enamides with quinone monoimines promoted by a chiral phosphoric acid

Zhang, Minmin,Yu, Shuowen,Hu, Fangzhi,Liao, Yijun,Liao, Lihua,Xu, Xiaoying,Yuan, Weicheng,Zhang, Xiaomei

, p. 8757 - 8760 (2016/07/15)

Enantioselective [3+2] coupling of cyclic enamides with quinone monoimines was realised using a chiral phosphoric acid as a catalyst. This transformation allowed for the synthesis of highly enantioenriched polycyclic 2,3-dihydrobenzofurans (up to 99.9% ee). The absolute configuration of one product was determined by an X-ray crystal structural analysis. We also found a possible mechanism for this reaction.

Enantioselective halogenative semi-pinacol rearrangement: Extension of substrate scope and mechanistic investigations

Romanov-Michailidis, Fedor,Romanova-Michaelides, Maria,Pupier, Marion,Alexakis, Alexandre

, p. 5561 - 5583 (2015/03/30)

The present Full Paper article discloses a survey of our recent results obtained in the context of the enantioselective halogenation-initiated semi-pinacol rearrangement. Commencing with the fluorination/semi-pinacol reaction first and moving to the heavier halogens (bromine and iodine) second, the scope and limitations of the halogenative phase-transfer methodology will be discussed and compared. An extension of the fluorination/semi-pinacol reaction to the ring-expansion of five-membered allylic cyclopentanols will be also described, as well as some preliminary results on substrates prone to desymmetrization will be given. Finally, the present manuscript will culminate with a detailed mechanistic investigation of the canonical fluorination/semi-pinacol reaction. Our mechanistic discussion will be based on in situ reaction progress monitoring, complemented with substituent effect, kinetic isotopic effect and non-linear behaviour studies.

Enantioselective organocatalytic fluorination-induced Wagner-Meerwein rearrangement

Romanov-Michailidis, Fedor,Guénée, Laure,Alexakis, Alexandre

, p. 9266 - 9270 (2013/09/12)

Cracked under strain: Strained allylic cyclobutanols and cyclopropanols readily undergo a ring expansion described by the title rearrangement. This reaction is promoted by catalytic amounts of 1 and displays high tolerance with respect to the substrate scope. The corresponding β-fluoro spiroketone products are isolated in high yields and with excellent stereoselectivities. EDG=electron-donating group, EWG=electron-withdrawing group. Copyright

SUBSTITUTED AROMATIC CARBOXAMIDE AND UREA DERIVATIVES AS VANILLOID RECEPTOR LIGANDS

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Page/Page column 127; 129, (2010/11/18)

The invention relates to substituted aromatic carboxamide and urea derivatives, to processes for the preparation thereof, to pharmaceutical compositions containing these compounds and also to the use of these compounds for preparing pharmaceutical compositions (formula (I)).

BENZIMIDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF

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Page/Page column 33, (2009/12/23)

Provided is an ORL-1 receptor agonist having improved bioavailability based on superior metabolic stability and strong and high selectivity, as compared to conventional compounds. A compound represented by the formula (I) wherein each symbol is as defined

7-Substituted Purine Derivatives for Immunosuppression

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, (2008/12/05)

The present invention provides novel purinone and related derivatives useful for the prevention and treatment of autoimmune diseases, inflammatory disease, mast cell mediated disease and transplant rejection. The compounds are of the general formula III:

7-SUBSTITUTED PURINE DERIVATIVES FOR IMMUNOSUPPRESSION

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, (2008/12/05)

The present invention provides novel purinone and related derivatives useful for the prevention and treatment of autoimmune diseases, inflammatory disease, mast cell mediated disease and transplant rejection. The compounds are of the general formula (III).

SUBSTITUTED FLUOROETHYL UREAS AS ALPHA 2 ADRENERGIC AGENTS

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Page/Page column 39, (2008/12/04)

Therapeutic compounds, and methods, compositions, and medicaments related thereto are disclosed herein.

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