methyl (2E)-4-(1-hydroxycyclohexyl)-2-butenoate

Base Information

Chemical Name:methyl (2E)-4-(1-hydroxycyclohexyl)-2-butenoate
CAS No.:35490-10-9
Molecular Formula:C₁₁H₁₈O₃
Molecular Weight:198.262
Hs Code.:
DSSTox Substance ID:DTXSID201244990
Nikkaji Number:J1.486.699J

Synonyms:methyl (2E)-4-(1-hydroxycyclohexyl)-2-butenoate;DTXSID201244990;35490-10-9;(E)-4-(1-hydroxy-cyclohexyl)-but-2-enoic acid methyl ester

Suppliers and Price of methyl (2E)-4-(1-hydroxycyclohexyl)-2-butenoate

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 (2E)-4-(1-hydroxycyclohexyl)-2-butenoate

Chemical Property:

XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:198.125594432
Heavy Atom Count:14
Complexity:215

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC(=O)C=CCC1(CCCCC1)O
Isomeric SMILES:COC(=O)/C=C/CC1(CCCCC1)O

Technology Process of methyl (2E)-4-(1-hydroxycyclohexyl)-2-butenoate

There total 6 articles about methyl (2E)-4-(1-hydroxycyclohexyl)-2-butenoate 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: 56.0%

: 1117-71-1,56699-18-4,6000-00-6
methyl-4-bromo-2-butenoate

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 35490-10-9
(E)-4-(1'-Hydroxycyclohexyl)but-2-ensaeuremethylester

Guidance literature:: With silver; zinc; In tetrahydrofuran; Heating;

Reference yield:

: 1117-71-1,56699-18-4,6000-00-6
methyl-4-bromo-2-butenoate

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 41955-34-4,95728-87-3,95728-89-5
2-(1-hydroxy-cyclohexyl)-but-3-enoic acid methyl ester

: 35490-10-9
(E)-4-(1'-Hydroxycyclohexyl)but-2-ensaeuremethylester

Guidance literature:: With chromium dichloride; lithium iodide; In tetrahydrofuran; for 1h; Yield given. Yields of byproduct given. Title compound not separated from byproducts; Ambient temperature;
DOI:10.1055/s-1997-1219

Reference yield:

: 623-43-8
crotonic acid methyl ester

: 35490-10-9
(E)-4-(1'-Hydroxycyclohexyl)but-2-ensaeuremethylester

Guidance literature:: Multi-step reaction with 2 steps

1: NBS, AIBN

2: Zn, I₂

With N-Bromosuccinimide; 2,2'-azobis(isobutyronitrile); iodine; zinc;