Methyl (1S)-2-oxo-1-(prop-2-en-1-yl)cyclohexane-1-carboxylate

Base Information

Chemical Name:Methyl (1S)-2-oxo-1-(prop-2-en-1-yl)cyclohexane-1-carboxylate
CAS No.:58648-11-6
Molecular Formula:C11H16O3
Molecular Weight:196.246
Hs Code.:
DSSTox Substance ID:DTXSID80533225
Wikidata:Q82406391

Synonyms:58648-11-6;DTXSID80533225;Methyl (1S)-2-oxo-1-(prop-2-en-1-yl)cyclohexane-1-carboxylate

Suppliers and Price of Methyl (1S)-2-oxo-1-(prop-2-en-1-yl)cyclohexane-1-carboxylate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of Methyl (1S)-2-oxo-1-(prop-2-en-1-yl)cyclohexane-1-carboxylate

Chemical Property:

XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:196.109944368
Heavy Atom Count:14
Complexity:257

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1(CCCCC1=O)CC=C
Isomeric SMILES:COC(=O)[C@@]1(CCCCC1=O)CC=C

Technology Process of Methyl (1S)-2-oxo-1-(prop-2-en-1-yl)cyclohexane-1-carboxylate

There total 21 articles about Methyl (1S)-2-oxo-1-(prop-2-en-1-yl)cyclohexane-1-carboxylate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 91.0%

: 142977-27-3
methyl (1S)-1-allyl-2-<(1S,2S)-2-hydroxycyclohexan-1-yl>oxy-1-methyl-2-cyclohexen-1-carboxylate

: 89708-65-6
methyl (R)-1-allyl-2-oxocyclohexanecarboxylate

: 58648-11-6
methyl (S)-1-allyl-2-oxocyclohexanecarboxylate

Guidance literature:: With boron trifluoride diethyl etherate; water; In methanol; at 60 - 70 ℃; Yields of byproduct given. Title compound not separated from byproducts;

Reference yield: 81.0%

: 591-87-7
Allyl acetate

: 62269-47-0
2-((trimethylsilyl)oxy)cyclohex-1-enecarboxylic acid methyl ester

: 58648-11-6,89708-65-6,113541-80-3
methyl 2-allyl-2-cyclohexanonecarboxylate

Guidance literature:: With tris(dibenzylideneacetone)dipalladium⁽⁰⁾ chloroform complex; 1,2-bis-(diphenylphosphino)ethane; In tetrahydrofuran; Ambient temperature;
DOI:10.1016/S0040-4039(00)96134-3

Reference yield: 70.0%

: 591-87-7
Allyl acetate

: 41302-34-5
2-(methoxycarbonyl)cyclohexanone

: 58648-11-6,89708-65-6,113541-80-3
methyl 2-allyl-2-cyclohexanonecarboxylate

Guidance literature:: With tetrabutylammomium bromide; potassium carbonate; palladium dichloride; In tetrahydrofuran; for 5h; Heating;
DOI:10.1021/ol702099v