2-Propynoic acid, 3-(1-hydroxycyclohexyl)-, methyl ester

Base Information

Chemical Name:2-Propynoic acid, 3-(1-hydroxycyclohexyl)-, methyl ester
CAS No.:72036-33-0
Molecular Formula:C10H14O3
Molecular Weight:182.219
Hs Code.:
DSSTox Substance ID:DTXSID10402677
Nikkaji Number:J570.582G

Synonyms:2-Propynoic acid, 3-(1-hydroxycyclohexyl)-, methyl ester;72036-33-0;methyl 3-(1-hydroxycyclohexyl)prop-2-ynoate;methyl 3-(1-hydroxycyclohexyl)propiolate;DTXSID10402677;LVUQPCAQXKXOEE-UHFFFAOYSA-N;D87021;3-(1-Hydroxycyclohexyl)propiolic acid methyl ester;2-Propynoicacid,3-(1-hydroxycyclohexyl)-,methylester

Suppliers and Price of 2-Propynoic acid, 3-(1-hydroxycyclohexyl)-, methyl ester

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 4 raw suppliers

Chemical Property of 2-Propynoic acid, 3-(1-hydroxycyclohexyl)-, methyl ester

Chemical Property:

XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:182.094294304
Heavy Atom Count:13
Complexity:250

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C#CC1(CCCCC1)O

Technology Process of 2-Propynoic acid, 3-(1-hydroxycyclohexyl)-, methyl ester

There total 7 articles about 2-Propynoic acid, 3-(1-hydroxycyclohexyl)-, methyl ester 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:

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

: 922-67-8
propynoic acid methyl ester

: 72036-33-0
methyl 3-(1-hydroxycyclohexyl)-2-propynoate

Guidance literature:: With n-butyllithium; Yield given. Multistep reaction; 1. -120 deg C, THF, ether, pentane;
DOI:10.1021/jo01289a006

Reference yield:

: 67-56-1
methanol

: 201230-82-2
carbon monoxide

: 78-27-3
1-Ethynylcyclohexan-1-ol

: [2-Oxo-1-oxa-spiro[3.5]non-(3Z)-ylidene]-acetic acid methyl ester

: (Z)-2-(1-Hydroxy-cyclohexyl)-but-2-enedioic acid 4-methyl ester

: (Z)-2-(1-Hydroxy-cyclohexyl)-but-2-enedioic acid dimethyl ester

: 72036-33-0
methyl 3-(1-hydroxycyclohexyl)-2-propynoate

Guidance literature:: With air; potassium iodide; palladium(II) iodide; at 80 ℃; for 5h; under 15200 Torr; Further byproducts given;
DOI:10.1039/a603892a

Reference yield:

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

: 72036-33-0
methyl 3-(1-hydroxycyclohexyl)-2-propynoate

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) (i-Pr)2N^(1-) / 1) 0 deg C; 2) THF

2: H⁽¹⁺⁾

With diisopropylamide; hydrogen cation;