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Tert-butyl 3-oxo-2-oxa-8-azaspiro[4.5]decane-8-carboxylate is a highly complex chemical compound characterized by its unique and intricate molecular structure. It is a carboxylate ester that features a tert-butyl group and a 3-oxo-2-oxa-8-azaspiro[4.5]decane moiety. tert-butyl 3-oxo-2-oxa-8-azaspiro[4.5]decane-8-carboxylate is notable for its potential applications in the pharmaceutical and agrochemical industries, driven by its spirocyclic structure which may exhibit intriguing biological activities. The presence of functional groups such as the carboxylate ester and the oxo group also render this compound a valuable building block for the synthesis of more complex molecules. Its specific properties and potential uses across various industries highlight tert-butyl 3-oxo-2-oxa-8-azaspiro[4.5]decane-8-carboxylate as an interesting and significant chemical compound for ongoing research and development.

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  • 203662-19-5 Structure
  • Basic information

    1. Product Name: tert-butyl 3-oxo-2-oxa-8-azaspiro[4.5]decane-8-carboxylate
    2. Synonyms: tert-butyl 3-oxo-2-oxa-8-azaspiro[4.5]decane-8-carboxylate
    3. CAS NO:203662-19-5
    4. Molecular Formula: C13H21NO4
    5. Molecular Weight: 255.31014
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 203662-19-5.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: tert-butyl 3-oxo-2-oxa-8-azaspiro[4.5]decane-8-carboxylate(CAS DataBase Reference)
    10. NIST Chemistry Reference: tert-butyl 3-oxo-2-oxa-8-azaspiro[4.5]decane-8-carboxylate(203662-19-5)
    11. EPA Substance Registry System: tert-butyl 3-oxo-2-oxa-8-azaspiro[4.5]decane-8-carboxylate(203662-19-5)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 203662-19-5(Hazardous Substances Data)

203662-19-5 Usage

Uses

Used in Pharmaceutical Industry:
Tert-butyl 3-oxo-2-oxa-8-azaspiro[4.5]decane-8-carboxylate is used as a building block for the synthesis of complex molecules due to its unique spirocyclic structure and functional groups, which may contribute to the development of new pharmaceutical agents with novel biological activities.
Used in Agrochemical Industry:
In the agrochemical sector, tert-butyl 3-oxo-2-oxa-8-azaspiro[4.5]decane-8-carboxylate is utilized as a precursor in the creation of new agrochemical compounds, potentially leading to the discovery of innovative products with enhanced efficacy in crop protection and management.

Check Digit Verification of cas no

The CAS Registry Mumber 203662-19-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,0,3,6,6 and 2 respectively; the second part has 2 digits, 1 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 203662-19:
(8*2)+(7*0)+(6*3)+(5*6)+(4*6)+(3*2)+(2*1)+(1*9)=105
105 % 10 = 5
So 203662-19-5 is a valid CAS Registry Number.

203662-19-5Relevant articles and documents

Discovery of novel spirocyclic inhibitors of fatty acid amide hydrolase (FAAH). Part 1: Identification of 7-azaspiro[3.5]nonane and 1-oxa-8-azaspiro[4. 5]decane as lead scaffolds

Meyers, Marvin J.,Long, Scott A.,Pelc, Matthew J.,Wang, Jane L.,Bowen, Scott J.,Walker, Mark C.,Schweitzer, Barbara A.,Madsen, Heather M.,Tenbrink, Ruth E.,McDonald, Joseph,Smith, Sarah E.,Foltin, Susan,Beidler, David,Thorarensen, Atli

experimental part, p. 6538 - 6544 (2011/12/04)

Herein we report the identification of two new fatty acid amide hydrolase (FAAH) inhibitor lead series with FAAH kinact/Ki potency values greater than 1500 M-1s-1. The two novel spirocyclic cores, 7-azaspiro[3.5]nonane and 1-oxa-8-azaspiro[4.5]decane, clearly distinguished themselves from the other spirocyclic cores on the basis of their superior potency for FAAH. Lead compounds from these two series have suitable FAAH potency and selectivity for additional medicinal chemistry optimization.

Synthesis and structure-activity relationship of a novel sulfone series of TNF-α converting enzyme inhibitors

Xue, Chu-Biao,Chen, Xiao-Tao,He, Xiaohua,Roderick, John,Corbett, Ronald L.,Ghavimi, Bahman,Liu, Rui-Qin,Covington, Maryanne B.,Qian, Mingxin,Ribadeneira, Maria D.,Vaddi, Krishna,Trzaskos, James,Newton, Robert C.,Duan, James J.-W.,Decicco, Carl P.

, p. 4453 - 4459 (2007/10/03)

Replacement of the amide functionality in IM491 (N-hydroxy-(5S,6S)-1- methyl-6-{[4-(2-methyl-4-quinolinylmethoxy)anilinyl]carbonyl} -5-piperidinecarboxamide) with a sulfonyl group led to a new series of α,β-cyclic and β,β-cyclic γ-sulfonyl hydroxamic acids, which were potent TNF-α converting enzyme (TACE) inhibitors. Among them, inhibitor 4b (N-hydroxy-(4S,5S)-1-methyl-5-{[4-(2-methyl-4- quinolinylmethoxy)phenyl]sulfonylmethyl}-4-pyrrolidinecarboxamide) exhibited IC50 values of 1 nM and 180 nM in porcine TACE (pTACE) and cell assays, respectively, with excellent selectivity over MMP-1, -2, -9 and -13 and was orally bioavailable with an F value of 46% in mice.

Phthalazine derivatives and remedies for erectile dysfunction

-

, (2008/06/13)

The present invention provides a phthalazine compound as a therapeutic agent for erectile dysfunction represented by the following formula, a pharmacologically acceptable salt thereof or a hydrate thereof: wherein R1and R2are the same as or different from each other and represent a halogen atom, a C1 to C4 alkyl group which may be substituted with a halogen atom, a C1 to C4 alkoxy group which may be substituted with a halogen atom or a cyano group; X represents a cyano group, a nitro group, a halogen atom, a hydroxyimino group which may be substituted or a heteroaryl group which may be substituted; Y represents a heteroaryl group, an aryl group which may be substituted, an alkynyl group which may substituted, an alkenyl group, an alkyl group, an optionally substituted saturated or unsaturated 4- to 8-membered amine ring, and the cyclic amine compound is a monocyclic compound, bicyclic compound or a spiro compound; l is an integer of 1 to 3; provided that the case where l is 1 or 2, X is a cyano group, a nitro group or a chlorine atom, R1is a chlorine atom, R2is a methoxy group and Y is a 5- or 6-membered amine ring substituted with a hydroxyl group is excluded.

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