4-Pentynylcarbamic acid benzyl ester

Base Information

Chemical Name:4-Pentynylcarbamic acid benzyl ester
CAS No.:236394-24-4
Molecular Formula:C13H15NO2
Molecular Weight:217.26
Hs Code.:
DSSTox Substance ID:DTXSID20450109
Wikidata:Q82269687
Mol file:236394-24-4.mol

Synonyms:4-Pentynylcarbamic acid benzyl ester;236394-24-4;Benzyl N-pent-4-ynylcarbamate;Benzyl pent-4-yn-1-ylcarbamate;Carbamic acid, 4-pentynyl-, phenylmethyl ester (9CI);N-Z-4-pentyne-1-amine;DTXSID20450109;AB76419;BENZYL N-(PENT-4-YN-1-YL)CARBAMATE;CS-0348252;N-Z-4-pentyne-1-amine, >=95.0% (GC);EN300-7063276;A1-18893

Suppliers and Price of 4-Pentynylcarbamic acid benzyl 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

Sigma-Aldrich
N-Z-4-pentyne-1-amine ≥95.0% (GC)
500mg
$ 110.00

A1 Biochem Labs
Benzylpent-4-yn-1-ylcarbamate 95%
2.5 g
$ 1200.00

Total 2 raw suppliers

Chemical Property of 4-Pentynylcarbamic acid benzyl ester

Chemical Property:

PSA：41.82000
LogP:2.53060
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:217.110278721
Heavy Atom Count:16
Complexity:248

Purity/Quality:

99% ^*data from raw suppliers

N-Z-4-pentyne-1-amine ≥95.0% (GC) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C#CCCCNC(=O)OCC1=CC=CC=C1

Technology Process of 4-Pentynylcarbamic acid benzyl ester

There total 1 articles about 4-Pentynylcarbamic acid benzyl 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:

: 88761-58-4
5-isocyanato-1-pentyne

: 100-51-6,185532-71-2
benzyl alcohol

: 236394-24-4
benzyl 4-pentynylcarbamate

Guidance literature:: In benzene; for 2h; Heating;
DOI:10.1021/ol990063q

Reference yield: 72.0%

: 236394-24-4
benzyl 4-pentynylcarbamate

: 4-azido-2-(2-(2-oxoimidazolidin-1-yl)ethoxy)benzonitrile

: benzyl(3-(1-(4-cyano-3-((1-(2-oxoimidazolidin-1-yl)ethoxy)phenyl)-1H-1,2,3-triazol-4-yl))propyl)carbamate

Guidance literature:: With copper(ll) sulfate pentahydrate; sodium L-ascorbate; In ethanol; water; Darkness; Inert atmosphere;
DOI:10.1021/acs.jmedchem.1c00206

Reference yield:

: 236394-24-4
benzyl 4-pentynylcarbamate

: 696-62-8
para-iodoanisole

: benzyl (5-(4-methoxyphenyl)pent-4-yn-1-yl)carbamate

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; triethylamine; at 25 ℃; Sealed tube; Inert atmosphere;
DOI:10.1021/acs.orglett.8b00648