Ethyl 3-(2-methoxyphenyl)prop-2-ynoate

Base Information

Chemical Name:Ethyl 3-(2-methoxyphenyl)prop-2-ynoate
CAS No.:80220-94-6
Molecular Formula:C12H12 O3
Molecular Weight:204.225
Hs Code.:
DSSTox Substance ID:DTXSID70534448
Nikkaji Number:J612.148I
Wikidata:Q82408280
Mol file:80220-94-6.mol

Synonyms:80220-94-6;ethyl 3-(2-methoxyphenyl)prop-2-ynoate;(2-METHOXY-PHENYL)-PROPYNOIC ACID ETHYL ESTER;Ethyl 3-(2-methoxyphenyl)propiolate;2-Propynoic acid,3-(2-methoxyphenyl)-, ethyl ester;starbld0037161;SCHEMBL852401;DTXSID70534448;UBCAJFXTYQISOG-UHFFFAOYSA-N;MFCD07773000

Suppliers and Price of Ethyl 3-(2-methoxyphenyl)prop-2-ynoate

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

Rieke Metals
(2-Methoxy-phenyl)-propynoicacidethylester
5g
$ 1728.00

Rieke Metals
(2-Methoxy-phenyl)-propynoicacidethylester
1g
$ 661.00

American Custom Chemicals Corporation
(2-METHOXY-PHENYL)PROPYNOIC ACID ETHYL ESTER 95.00%
5MG
$ 499.19

Total 4 raw suppliers

Chemical Property of Ethyl 3-(2-methoxyphenyl)prop-2-ynoate

Chemical Property:

PSA：35.53000
LogP:1.60980
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:204.078644241
Heavy Atom Count:15
Complexity:271

Purity/Quality:

97% ^*data from raw suppliers

(2-Methoxy-phenyl)-propynoicacidethylester ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C#CC1=CC=CC=C1OC

Technology Process of Ethyl 3-(2-methoxyphenyl)prop-2-ynoate

There total 17 articles about Ethyl 3-(2-methoxyphenyl)prop-2-ynoate 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: 89.0%

: indium(III) chloride

: 529-28-2
4-iodoanisol

: 623-47-2
propynoic acid ethyl ester

: 80220-94-6
ethyl 3-(2-methoxyphenyl)prop-2-ynoate

Guidance literature:: propynoic acid ethyl ester; With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃; for 0.166667h; Inert atmosphere;

indium(III) chloride; In tetrahydrofuran; hexane; at -78 - 20 ℃; for 0.333333h; Inert atmosphere;

4-iodoanisol; With tris(dibenzylideneacetone)dipalladium⁽⁰⁾ chloroform complex; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In tetrahydrofuran; hexane; at 80 ℃; for 1.5h; Inert atmosphere;
DOI:10.1055/s-0033-1339110

Reference yield: 88.0%

: (α-ethoxycarbonyl-α-2-methoxybenzoylmethylene)triphenylphosphorane

: 80220-94-6
ethyl 3-(2-methoxyphenyl)prop-2-ynoate

Guidance literature:: at 500 ℃; under 0.1 - 1 Torr;

Reference yield: 85.0%

: 529-28-2
4-iodoanisol

: 623-47-2
propynoic acid ethyl ester

: 80220-94-6
ethyl 3-(2-methoxyphenyl)prop-2-ynoate

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; potassium carbonate; In 1,2-dimethoxyethane; at 40 ℃; for 13h; Schlenk technique; Inert atmosphere;
DOI:10.1002/ejoc.202000823