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**Oxepin, 4,5-dihydro-** (7CI,8CI,9CI) is a seven-membered heterocyclic compound containing an oxygen atom, with partial saturation at the 4,5-positions. This study demonstrates its synthesis via the Cope rearrangement of cis-2,3-divinyl epoxides, enabling stereocontrol at C4 and C5 to produce both cis and trans isomers. These derivatives serve as key intermediates for constructing the oxepin core in natural products like aranotin. The method highlights the utility of divinyl epoxide precursors and olefination reactions in achieving precise stereochemical outcomes.

29329-01-9

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29329-01-9 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 29329-01-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 2,9,3,2 and 9 respectively; the second part has 2 digits, 0 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 29329-01:
(7*2)+(6*9)+(5*3)+(4*2)+(3*9)+(2*0)+(1*1)=119
119 % 10 = 9
So 29329-01-9 is a valid CAS Registry Number.

29329-01-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 4,5-dihydro-oxepin

1.2 Other means of identification

Product number -
Other names 4,5-dihydrooxepine

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:29329-01-9 SDS

29329-01-9Downstream Products

29329-01-9Relevant academic research and scientific papers

Pyrolysis of tricyclic cyclobutane-fused sulfolanes as a route to cis-1,2-divinyl compounds and their Cope-derived products

Aitken, R. Alan,Cadogan, J. I. G.,Gosney, Ian,Humphries, Caroline M.,McLaughlin, Leo M.,Wyse, Stuart J.

, p. 605 - 614 (2007/10/03)

Functionalisation of the double bond of 3-thiabicyclohept-6-ene 3, readily formed by hydrolysis of the cycloadduct 1 of 3-sulfolene and maleic anhydride followed by oxidative bis-decarboxylation, gives tricyclic sulfones 5-7 and 9 with the bicyclo2,4> skeleton. FVP of 3 results in stereospecific extrusion of SO2 to give Z-hexa-1,3,5-triene which undergoes electrocylisation to give cyclohexa-1,3-diene while reaction of 3 with LiAlH4 results in non-stereospecific extrusion to give Z- and E-hexa-1,3,5-triene. Upon FVP the tricyclic sulfones 5-7 and 9 lose SO2 to give 7-membered ring products 16-19 by Cope rearrangement of the initially formed cis-1,2-divinyl intermediates 15. The 1,3-dipolar cycloaddition of nitrile oxides and a nitrone to the double bond of 3 gives tricyclic sulfones with the tricyclo2,6> skeleton and a wider variety of these can be prepared by conventional reactions of 1. Upon FVP these lose SO2 to give stable cis-1,2-divinyl compounds 23, 24, 37-40 and 41-44. The Diels-Alder adducts 48 and 49 have been prepared from 3 and these behave differently upon FVP, losing SO2 and butadiene to give tetrasubstituted benzenes, in the latter case by way of an unexpected tetracyclic intermediate.

Extension of the Criegee Rearrangement: Synthesis of Enol Ethers from Secondary Allylic Hydroperoxides

Goodman, Richard M.,Kishi, Yoshito

, p. 5125 - 5127 (2007/10/02)

The Criegee rearrangement has been extended to secondary allylic hydroperoxides, allowing for the selective synthesis of cyclic and acyclic enol ethers; the effect of base and electrophilic agent was studied.

An examination of the affect of the epoxide stereochemistry in the nitrogen extrusion from exo- And endo-6,7-diazo-3-oxotricyclo[3.2.2.02,4]Non-6-ene

Liao, Yusheng,White, James B.

, p. 5129 - 5132 (2007/10/02)

The exo and endo isomers of 6,7-diazo-3-oxotricyclo[3.2.2.02,4]non-6-ene have been prepared and their extrusion of nitrogen examined. The exo isomer 10 underwent the expected homo-retro-Diels-Alder reaction at room temperature to give 4,5-dihydrooxepin (11), but the endo isomer extruded nitrogen at>180 °C to give cyclohexenone.

3-Thiabicyclohept-6-ene 3,3-Dioxide: A Novel Synthon for cis-1,2-Divinyl Intermediates and Derived Seven-membered Ring Systems

Aitken, R. Alan,Cadogan, J. I. G.,Gosney, Ian,Hamill, Brendan J.,McLaughlin, Leo M.

, p. 1164 - 1165 (2007/10/02)

Functionalisation of the 6,7-double bond in the novel bicyclic sulphone, 3-thiabicyclohept-6-ene 3,3-dioxide, followed by thermal extrusion of SO2, allows direct entry into seven-membered ring systems via a Cope rearrangement of the resulting cis-1

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