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8,8-difluoro-1,4-dioxaspiro[4.5]decane is a specialized organofluorine chemical compound characterized by a unique spiro molecular structure, which includes a 4-atom ring and a 5-atom ring connected at one specific atom. 8,8-difluoro-1,4-dioxaspiro[4.5]decane is part of a subclass of organic compounds known for the presence of a carbon-fluorine bond.

176251-49-3

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176251-49-3 Usage

Uses

As of the current knowledge, 8,8-difluoro-1,4-dioxaspiro[4.5]decane does not appear to have widely recognized applications in commercial or industrial settings. The exact properties, use, and toxicology of 8,8-difluoro-1,4-dioxaspiro[4.5]decane may depend on various factors, and further research is needed to explore its potential applications. If future studies reveal specific uses, they could be listed as follows:
Used in [Application Industry]:
8,8-difluoro-1,4-dioxaspiro[4.5]decane is used as [application type] for [application reason], once its properties and potential uses are better understood and validated.

Check Digit Verification of cas no

The CAS Registry Mumber 176251-49-3 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,7,6,2,5 and 1 respectively; the second part has 2 digits, 4 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 176251-49:
(8*1)+(7*7)+(6*6)+(5*2)+(4*5)+(3*1)+(2*4)+(1*9)=143
143 % 10 = 3
So 176251-49-3 is a valid CAS Registry Number.

176251-49-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 8,8-Difluoro-1,4-dioxaspiro[4.5]decane

1.2 Other means of identification

Product number -
Other names 4,4-difluorocyclohexanone ethylene acetal

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:176251-49-3 SDS

176251-49-3Relevant academic research and scientific papers

BENZAMIDES OF PYRAZOLYL-AMINO-PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF

-

Paragraph 00394, (2020/07/07)

Provided is a novel class of orally and/or topically available, selective and potent JAK inhibitors as safe and effective therapeutics against various diseases and disorders. More particularly, provided are pharmaceutical composition of these compounds and methods of their preparation and use thereof.

Method for synthesizing 8,8-difluoro-1,4- dioxaspiro[4.5]decane

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Paragraph 0032-0039; 0046; 0054; 0059; 0064-0065; 0070; 0076, (2018/11/26)

The invention discloses a method for synthesizing 8,8-difluoro-1,4-dioxaspiro[4.5]decane. The method comprises the following steps: first, 1,4-cyclohexanedione monoethylene ketal is reacted with a fluorinating agent to form a mixture of 8,8-difluoro-1,4-dioxaspiro[4.5]decane and impurity 8-fluoro-1,4-dioxaspiro[4.5]deca-7-ene; and using a substitute of the mixture and anhydrous hydrofluoric acid to obtain 8,8-difluoro-1,4-dioxaspiro[4.5]decane under the action of the catalyst boron trifluoride complex. In the synthetic method, raw material sources are wide, the price is low, impurities are reutilized by reasonable adding of the catalyst, the production cost is reduced, the production efficiency is improved, raw material and product waste is avoided, the problems of low product yield and low purity are effectively solved, the economic benefit is very obvious, the environmental pollution is small, and the method is especially suitable for large-scale industrial application and promotion.

Method for synthesizing 4-fluorocyclohexanone

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Paragraph 0100-0105, (2018/05/16)

The invention discloses a method for synthesizing 4-fluorocyclohexanone. The method comprises steps as follows: under the alkaline condition, 1,4-cyclohexanedione monoethylene ketal and a fluorinatingagent are subjected to highly selective reaction, and 8-fluoro-1,4-dioxaspiro[4.5]deca-7-ene is produced; 8-fluoro-1,4-dioxaspiro[4.5]decane is prepared from 8-fluoro-1,4-dioxaspiro[4.5]deca-7-ene and hydrogen under the action of a palladium-carbon catalyst; 8-fluoro-1,4-dioxaspiro[4.5]decane is subjected to deprotection with added acid, and 4-fluorocyclohexanone is obtained. According to the method, 1,4-cyclohexanedione monoethylene ketal which is widely sourced and low in cost is taken as a reaction raw material, a high-purity intermediate can be obtained maximumly in each reaction, so thatthe total yield of the whole reaction is high, purity of a final product is up to 98%, the economic benefit is quite remarkable, less environmental pollution is produced, and the method is particularly suitable for large-scale industrial application and popularization.

Fused tricyclic hepatitis virus inhibitor and application thereof

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Paragraph 0670; 0671; 0672; 0673, (2016/12/26)

The invention belongs to the field of medical chemistry, relates to a fused tricyclic hepatitis virus inhibitor and application thereof, and particularly, provides a compound of the general formula I or pharmaceutically acceptable salt, isomer, solvate, crystal or prodrug thereof, and a medicine composition containing the compounds and application of the compounds or the composition in medicine preparation. The compound has the good inhibiting activity on hepatitis C virus, meanwhile has the low toxicity on host cells, and is high in effectiveness, good in safety and likely to become the medicine for treating and/or preventing diseases relevant to HCV infection.

NOVEL BENZAMIDE DERIVATIVE AND USE THEREOF

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Paragraph 0122-0124, (2014/10/16)

Disclosed are a novel benzamide derivative and pharmaceutical use thereof, and more particularly, a novel benzamide derivative having a structure of Formula 1 or pharmaceutically acceptable salts thereof, and a composition for prevention or treatment of pain or itching including the above material. The novel benzamide derivative and pharmaceutically acceptable salt thereof according to the present invention exhibit excellent pain-suppressive effect and, in particular, pain-suppressive effect in not only a neuropathic animal model but also other models such as a formalin model, and therefore, may be used in suppression of different pains such as nociceptive pain, chronic pain, etc. Further, since it was demonstrated that the present invention displays anti-pruritic efficacy even in an itching model, to which a mechanism and treatment concept established with respect to pain is applied, the present invention may also be effectively used in radical treatment of atopic dermatitis by applying the inventive product to an anti-pruritic composition in order to suppress an initial itching stage and treat symptoms thereof, thus preventing skin damage or inflammation after the scratching stage.

NOVEL BENZAMIDE DERIVATIVE AND USE THEREOF

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Paragraph 0190; 0191; 0192; 0193, (2014/11/27)

Disclosed are a novel benzamide derivative and pharmaceutical use thereof, and more particularly, a novel benzamide derivative having a structure of Formula 1 or pharmaceutically acceptable salts thereof, and a composition for prevention or treatment of pain or itching including the above material. The novel benzamide derivative and pharmaceutically acceptable salt thereof according to the present invention exhibit excellent pain-suppressive effect and, in particular, pain-suppressive effect in not only a neuropathic animal model but also other models such as a formalin model, and therefore, may be used in suppression of different pains such as nociceptive pain, chronic pain, etc. Further, since it was demonstrated that the present invention displays anti-pruritic efficacy even in an itching model, to which a mechanism and treatment concept established with respect to pain is applied, the present invention may also be effectively used in radical treatment of atopic dermatitis by applying the inventive product to an anti-pruritic composition in order to suppress an initial itching stage and treat symptoms thereof, thus preventing skin damage or inflammation after the scratching stage.

Palladium catalyzed decarboxylative rearrangement of N-alloc indoles

Chen, Jun,Cook, Matthew J.

supporting information, p. 1088 - 1091 (2013/04/10)

A highly efficient palladium catalyzed decarboxylative allylic rearrangement of alloc indoles has been developed. This can also be combined with a Suzuki-Miyaura cross-coupling reaction in a single pot transformation. Substituted alloc groups and benzylic variants have also been demonstrated alongside promising initial results on the enantioselective variant.

1-Amino-4,4-difluorocyclohexanecarboxylic acid as a promising building block for drug discovery: Design, synthesis and characterization

Mykhailiuk, Pavel K.,Starova, Viktoriia,Iurchenko, Vladimir,Shishkina, Svitlana V.,Shishkin, Oleg V.,Khilchevskyi, Oleksandr,Zaporozhets, Olga

, p. 4066 - 4075 (2013/06/26)

1-Amino-4,4-difluorocyclohexanecarboxylic acid has been designed as a fluorinated analogue of the pharmacologically relevant 1- aminocyclohexanecarboxylic acid. The synthesis has been performed in three steps from a commercially available material in 22% overall yield. An impact of fluorine atoms on conformation, lipophilicity, acidity and fluorescent properties of the amino acid has been studied. Various practical applications of the obtained compound are suggested.

Deoxofluorination reactions using N,N-disubstituted aminodifluorosulfinium tetrafluoroborate salts

Mahé, Olivier,L'Heureux, Alexandre,Couturier, Michel,Bennett, Christopher,Clayton, Simon,Tovell, David,Beaulieu, Francis,Paquin, Jean-Fran?ois

, p. 57 - 60 (2013/11/06)

The synthesis of N,N-disubstituted aminodifluorosulfinium tetrafluoroborate salts is reported, and their behavior as deoxofluorinating agent was evaluated. The deoxofluorination reactions were performed using a primary alcohol, a secondary alcohol and a ketone. Results show that subtle modification of the structure of the reagents can noticeably affect the reactivity and the selectivity in deoxofluorination reactions.

Aminodifluorosulfinium salts: Selective fluorination reagents with enhanced thermal stability and ease of handling

Lheureux, Alexandre,Beaulieu, Francis,Bennett, Christopher,Bill, David R.,Clayton, Simon,Laflamme, Franois,Mirmehrabi, Mahmoud,Tadayon, Sam,Tovell, David,Couturier, Michel

supporting information; experimental part, p. 3401 - 3411 (2010/07/07)

Diethylaminodifluorosulfinium tetrafluoroborate (XtalFluor-E) and morpholinodifluorosulfinium tetrafluoroborate (XtalFluor-M) are crystalline fluorinating agents that are more easily handled and significantly more stable than Deoxo-Fluor, DAST, and their analogues. These reagents can be prepared in a safer and more cost-efficient manner by avoiding the laborious and hazardous distillation of dialkylaminosulfur trifluorides. Unlike DAST, Deoxo-Fluor, and Fluolead, XtalFluor reagents do not generate highly corrosive free-HF and therefore can be used in standard borosilicate vessels. When used in conjunction with promoters such as Et3N3HF, Et3N2HF, or DBU, XtalFluor reagents effectively convert alcohols to alkyl fluorides and carbonyls to gem-difluorides. These reagents are typically more selective than DAST and Deoxo-Fluor and exhibit superior performance by providing significantly less elimination side products.

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