2-Propynoic acid, 3-phenyl-, butyl ester

Base Information

Chemical Name:2-Propynoic acid, 3-phenyl-, butyl ester
CAS No.:80220-93-5
Molecular Formula:C13H14O2
Molecular Weight:202.253
Hs Code.:
DSSTox Substance ID:DTXSID90472156
Nikkaji Number:J191.668H
Wikidata:Q82300947

Synonyms:2-Propynoic acid, 3-phenyl-, butyl ester;80220-93-5;n-butyl phenylpropynoate;Butyl 3-phenylprop-2-ynoate;SCHEMBL5680676;DTXSID90472156;ZSCXDZVDJROKDN-UHFFFAOYSA-N;3-phenyl-prop-2-ynoic acid butyl ester

Suppliers and Price of 2-Propynoic acid, 3-phenyl-, butyl 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 2 raw suppliers

Chemical Property of 2-Propynoic acid, 3-phenyl-, butyl ester

Chemical Property:

Vapor Pressure:0.001mmHg at 25°C
XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:202.099379685
Heavy Atom Count:15
Complexity:250

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCOC(=O)C#CC1=CC=CC=C1

Technology Process of 2-Propynoic acid, 3-phenyl-, butyl ester

There total 16 articles about 2-Propynoic acid, 3-phenyl-, butyl 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: 100.0%

: 109-65-9
1-bromo-butane

: 124-38-9,18923-20-1
carbon dioxide

: 536-74-3
phenylacetylene

: 80220-93-5
phenylpropiolic acid n-butyl ester

Guidance literature:: With caesium carbonate; In N,N-dimethyl-formamide; at 80 ℃; for 16h; under 1520.1 Torr; Reagent/catalyst;
DOI:10.1134/S1070428019120017

Reference yield: 98.0%

: 536-74-3
phenylacetylene

: 592-34-7
carbonochloridic acid, butyl ester

: 80220-93-5
phenylpropiolic acid n-butyl ester

Guidance literature:: With 1,2,2,6,6-pentamethylpiperidine; dmap; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In dichloromethane; at 40 ℃; for 26h;
DOI:10.1039/a908458d

Reference yield: 96.0%

: 542-69-8
1-iodo-butane

: 124-38-9,18923-20-1
carbon dioxide

: 536-74-3
phenylacetylene

: 80220-93-5
phenylpropiolic acid n-butyl ester

Guidance literature:: With copper(l) iodide; caesium carbonate; at 80 ℃; for 18h; Reagent/catalyst; Time; Temperature; Solvent; Catalytic behavior; Schlenk technique;
DOI:10.1039/c3gc40896e