2-(4-Phenoxyphenoxy)ethyl Thiocyanate

Base Information

Chemical Name:2-(4-Phenoxyphenoxy)ethyl Thiocyanate
CAS No.:205381-53-9
Molecular Formula:C15H13NO2S
Molecular Weight:271.34
Hs Code.:
DSSTox Substance ID:DTXSID60437616
Nikkaji Number:J950.560A
Wikidata:Q27465162
ChEMBL ID:CHEMBL39581

Synonyms:4-phenoxyphenoxyethyl thiocyanate;WC-9 compound

Suppliers and Price of 2-(4-Phenoxyphenoxy)ethyl Thiocyanate

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 2-(4-Phenoxyphenoxy)ethyl Thiocyanate

Chemical Property:

XLogP3:4.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:271.06669983
Heavy Atom Count:19
Complexity:288

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)OC2=CC=C(C=C2)OCCSC#N

Technology Process of 2-(4-Phenoxyphenoxy)ethyl Thiocyanate

There total 2 articles about 2-(4-Phenoxyphenoxy)ethyl Thiocyanate 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: 73.0%

: 333-20-0
potassium thioacyanate

: 88356-00-7
(4-phenoxyphenoxyethyl)-4-toluenesulfonate

: 205381-53-9
2-(4-phenoxyphenoxy)ethyl thiocyanate

Guidance literature:: In N,N-dimethyl-formamide; at 100 ℃; for 3h;
DOI:10.1021/jm970860z

Reference yield:

: 63066-74-0
2-(4-phenoxyphenoxy)-ethanol

: 205381-53-9
2-(4-phenoxyphenoxy)ethyl thiocyanate

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) pyridine, 2.) aq. HCl / 1.) RT, 4 h, 2.) RT, 1 h

2: 73 percent / dimethylformamide / 3 h / 100 °C

With pyridine; hydrogenchloride; In N,N-dimethyl-formamide;
DOI:10.1021/jm970860z