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Tert-butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate is a spirocyclic chemical compound with the molecular formula C14H21N3O4. It features a triazine ring and a carboxylate functional group, which contribute to its diverse pharmacological activities and make it a valuable intermediate in the synthesis of biologically active compounds for pharmaceutical research.

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  • 887120-96-9 Structure
  • Basic information

    1. Product Name: tert-butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate
    2. Synonyms: tert-butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate;1'-Boc-spiro[hydantoin-5,3'-piperidine]
    3. CAS NO:887120-96-9
    4. Molecular Formula: C12H19N3O4
    5. Molecular Weight: 269.29696
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 887120-96-9.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.28±0.1 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. PKA: 10.00±0.20(Predicted)
    10. CAS DataBase Reference: tert-butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate(CAS DataBase Reference)
    11. NIST Chemistry Reference: tert-butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate(887120-96-9)
    12. EPA Substance Registry System: tert-butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate(887120-96-9)
  • 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: 887120-96-9(Hazardous Substances Data)

887120-96-9 Usage

Uses

Used in Organic Synthesis:
Tert-butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate is used as a building block in organic synthesis for the creation of various biologically active compounds due to its unique spirocyclic structure and functional groups.
Used in Pharmaceutical Research:
In pharmaceutical research, tert-butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate is utilized as an intermediate for the development of potential pharmaceuticals, leveraging its ability to display diverse pharmacological activities.
Used in Antibacterial Applications:
Tert-butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate is used as an antibacterial agent, given its potential to combat bacterial infections, making it a subject of interest in the development of new antimicrobial drugs.
Used in Antifungal Applications:
Similarly, in antifungal applications, tert-butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate is employed for its potential to inhibit fungal growth, contributing to the advancement of new antifungal medications.

Check Digit Verification of cas no

The CAS Registry Mumber 887120-96-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 8,8,7,1,2 and 0 respectively; the second part has 2 digits, 9 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 887120-96:
(8*8)+(7*8)+(6*7)+(5*1)+(4*2)+(3*0)+(2*9)+(1*6)=199
199 % 10 = 9
So 887120-96-9 is a valid CAS Registry Number.

887120-96-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name tert-butyl 2,4-dioxo-1,3,9-triazaspiro[4.5]decane-9-carboxylate

1.2 Other means of identification

Product number -
Other names tert-Butyl 2,4-dioxo-1,3,7-triazaspiro[4.5]decane-7-carboxylate

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:887120-96-9 SDS

887120-96-9Relevant articles and documents

Microwave-assisted synthesis of functionalized spirohydantoins as 3-D privileged fragments for scouting the chemical space

Prevet, Hugues,Flipo, Marion,Roussel, Pascal,Deprez, Benoit,Willand, Nicolas

supporting information, p. 2888 - 2894 (2016/06/14)

Fragment-based drug design has been successfully applied to a large set of proteins, however in order to expand this concept to the most demanding targets, such as protein-protein interactions, it is required to enrich current fragment libraries with new and original 3D privileged fragments. Our goal was to develop a rapid microwave-assisted synthesis of 27 new privileged spirohydantoin fragments. Among them 24 compounds showed a high water solubility. These molecules were plotted according to the normalized principal moments of inertia of their minimized conformers, and most of the compounds were prone to occupy under-populated regions of the triangular plot. Finally we demonstrated that the hydantoin ring can be selectively N-monoalkylated providing the access to rapid functionalization for further elaboration.

8 - SUBSTITUTED 2 -AMINO - [1,2,4] TRIAZOLO [1, 5 -A] PYRAZINES AS SYK TRYROSINE KINASE INHIBITORS AND GCN2 SERIN KINASE INHIBITORS

-

Page/Page column 171, (2013/09/12)

Compounds of the formula I in which R1, R2 and R4 have the meanings indicated in Claim 1, are inhibitors of Syk, and can be employed, inter alia, for the treatment of cancer, rheumatoid arthritis and / or systemic lupus

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