Thiocyanic acid, 2-isothiocyanato-2-phenylethyl ester

Base Information

Chemical Name:Thiocyanic acid, 2-isothiocyanato-2-phenylethyl ester
CAS No.:60211-94-1
Molecular Formula:C10H8N2S2
Molecular Weight:220.319
Hs Code.:
DSSTox Substance ID:DTXSID70483624

Synonyms:60211-94-1;Thiocyanic acid, 2-isothiocyanato-2-phenylethyl ester;DTXSID70483624

Suppliers and Price of Thiocyanic acid, 2-isothiocyanato-2-phenylethyl ester

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

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Chemical Property of Thiocyanic acid, 2-isothiocyanato-2-phenylethyl ester

Chemical Property:

XLogP3:4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:220.01289061
Heavy Atom Count:14
Complexity:257

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)C(CSC#N)N=C=S

Technology Process of Thiocyanic acid, 2-isothiocyanato-2-phenylethyl ester

There total 6 articles about Thiocyanic acid, 2-isothiocyanato-2-phenylethyl 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: 44.0%

: 100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6
styrene

: 29284-59-1
thiocyanogen bromide

: 42877-24-7
(1,2-dithiocyanatoethyl)benzene

: 60211-94-1
1-isothiocyanato-1-phenyl-2-thiocyanatoethane

: 77425-38-8
1-bromo-1-phenyl-2-thiocyanatoethane

Guidance literature:: With r; In chloroform; water; for 24h; Ambient temperature;
DOI:10.1039/P19810000058

Reference yield: 13.0%

: 100-42-5,25038-60-2,25247-68-1,28213-80-1,28325-75-9,79637-11-9,9003-53-6
styrene

: 302-04-5,1111-68-8,37223-05-5,62476-95-3,69924-38-5,81210-01-7,60168-45-8
Thiocyanate

: 189364-41-8
2-Phenyl-2-hydroxyethyl thiocyanate

: 42877-24-7
(1,2-dithiocyanatoethyl)benzene

: 60211-94-1
1-isothiocyanato-1-phenyl-2-thiocyanatoethane

: 5654-78-4
thiocyanato-1 phenyl-1 ethylene

: 5399-30-4
2-oxo-2-phenylethylthiocyanate

Guidance literature:: styrene; Thiocyanate; With sulfuric acid; In water; acetonitrile; at 0 ℃; Electrolysis; Green chemistry;

In dichloromethane; at 20 ℃; Overall yield = 38 %; Green chemistry;
DOI:10.1016/j.electacta.2015.07.127