107289-20-3 Usage
Description
(R)-2-TERT-BUTYL-6-METHYL-1,3-DIOXIN-4-ONE, a dioxin derivative with the molecular formula C10H16O2, features a tertiary butyl and a methyl group attached to the dioxin ring. This chemical compound is known for its role in the synthesis of pharmaceuticals and fine chemicals, as well as its utility as a building block in organic chemistry research and drug discovery. Its structural properties make it a promising candidate for the development of new drugs and therapeutic agents.
Uses
Used in Pharmaceutical Synthesis:
(R)-2-TERT-BUTYL-6-METHYL-1,3-DIOXIN-4-ONE is used as a key intermediate in the synthesis of various pharmaceuticals. Its unique structure allows for the creation of complex organic molecules that can be tailored for specific therapeutic applications.
Used in Fine Chemicals Production:
In the fine chemicals industry, (R)-2-TERT-BUTYL-6-METHYL-1,3-DIOXIN-4-ONE serves as a valuable building block for the production of specialty chemicals with specific properties and applications.
Used in Organic Chemistry Research:
(R)-2-TERT-BUTYL-6-METHYL-1,3-DIOXIN-4-ONE is utilized as a fundamental component in organic chemistry research, where it contributes to the understanding of molecular interactions and the development of novel chemical reactions.
Used in Drug Discovery:
(R)-2-TERT-BUTYL-6-METHYL-1,3-DIOXIN-4-ONE holds potential in medicinal chemistry for the development of new drugs and therapeutic agents, thanks to its ability to form complex organic molecules with potential biological activities.
Used as a Reagent in Chemical Reactions:
This dioxin derivative is also employed as a reagent in various chemical reactions, facilitating the formation of complex organic molecules that are essential in the creation of new compounds with specific applications across different industries.
Check Digit Verification of cas no
The CAS Registry Mumber 107289-20-3 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,0,7,2,8 and 9 respectively; the second part has 2 digits, 2 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 107289-20:
(8*1)+(7*0)+(6*7)+(5*2)+(4*8)+(3*9)+(2*2)+(1*0)=123
123 % 10 = 3
So 107289-20-3 is a valid CAS Registry Number.
InChI:InChI=1/C9H14O3/c1-6-5-7(10)12-8(11-6)9(2,3)4/h5,8H,1-4H3/t8-/m1/s1
107289-20-3Relevant articles and documents
Modified preparation of (2R)-2-tert-butyl-6-methyl-4H-1,3-dioxin-4-one; a chiral acetylacetic acid derivative for the synthesis of enantiopure compounds
Seebach,Gysel,Job,Beck
, p. 39 - 40 (1992)
An improved synthesis of the title compound in ca. 45% yield on up to a 174 mmol scale is reported. Bromination of (2R,6R)-2-tert-butyl-6-methyl-1,3-dioxan-4-one gives a mixture of mono- and dibromides which must be purified by chromatography to remove impurities which may poision the palladium catalyst in the following dehalogenation step.
123. 1,3-Dioxanone Derivatives from β-Hydroxy-carboxylic Acids and Pivalaldehyde. Versatile Buiding Blocks for Syntheses of Enantiomerically Pure Compounds. A Chiral Acetoacetic Acid Derivative
Seebach, Dieter,Zimmermann, Juerg
, p. 1147 - 1152 (2007/10/02)
(R)-3-Hydroxybutyric acid (from the biopolymer PHB) and pivalaldehyde give the crystalline cis- or (R,R)-2-(tert-butyl)-6-methyl-1,3-dioxan-4-one (1a), the enolate of which is stable at low temperature in THF solution and can be alkylated diastereoselectively (->3, 4, 5, and 7).Phenylselenation and subsequent elimination give an enantiomerically pure enol acetal 10 of aceto-acetic acid.Some reactions of 10 have been carried out, such as Michael addition (->11), alkylation on the CH3 substituent (->13), hydrogenation of the C=C bond (->1a) and photochemical cycloaddition (->16).The overall reactions are substitutions on the one sterogenic center of the starting β-hydroxy acid without racemization and without using a chiral auxiliary.
