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2-Hexanone, 1-(acetyloxy)-3-[bis(phenylmethyl)amino]-5-methyl-1-(methylthio)-, (3S)- is a complex organic compound with the molecular formula C23H27NO2S. It is a chiral molecule, with the (3S)- configuration indicating the spatial arrangement of its atoms. 2-Hexanone, 1-(acetyloxy)-3-[bis(phenylmethyl)amino]-5-methyl-1-(methylthio)-, (3S)- is characterized by a hexanone backbone, which is a six-carbon ketone chain. It features an acetyloxy group at the 1-position, a bis(phenylmethyl)amino group at the 3-position, a methyl group at the 5-position, and a methylthio group at the 1-position. The compound's structure and properties make it a potential candidate for various applications in the fields of pharmaceuticals, agrochemicals, and materials science, where its specific stereochemistry and functional groups could be exploited for targeted interactions.

189562-59-2

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189562-59-2 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 189562-59-2 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,8,9,5,6 and 2 respectively; the second part has 2 digits, 5 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 189562-59:
(8*1)+(7*8)+(6*9)+(5*5)+(4*6)+(3*2)+(2*5)+(1*9)=192
192 % 10 = 2
So 189562-59-2 is a valid CAS Registry Number.

189562-59-2SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name (3S)-1-acetoxy-3-(N,N-dibenzyl)amino-1-methylthio-5-methyl-2-oxohexane

1.2 Other means of identification

Product number -
Other names (3S)-1-acetoxy-3-(N,N-dibenzyl)amino-1-methylthio--5-methyl-2-oxo-hexane

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 -
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More Details:189562-59-2 SDS

189562-59-2Downstream Products

189562-59-2Relevant academic research and scientific papers

Remarkable diastereomeric rearrangement of an α-acyloxy β-ketosulfide to an α-acyloxy thioester: A novel approach to the synthesis of optically active (2S,3S) β-amino α-hydroxy acids

Suzuki, Takayuki,Honda, Yutaka,Izawa, Kunisuke,Williams, Robert M.

, p. 7317 - 7323 (2007/10/03)

A novel and efficient synthetic method is described for (2S,3S)-3-amino-2-hydroxy-4-phenyl butyric acid derivatives, which are useful intermediates of enzyme inhibitors. This involves a Pummerer rearrangement of a β-ketosulfoxide derived from L-phenylalanine followed by highly stereoselective acyl migration. From these studies, it appears that nitrogen-protecting groups exert a substantial influence over stereoselectivity. The mechanism of the rearrangement is discussed. β-Amino α-hydroxy carboxylic acids are important pharmaceutical intermediates, and this method may provide a versatile synthesis from various amino acids in a few steps.

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