3-(Hexadecanoyloxy)-4-phenyl-1,3-thiazole-2(3H)-thione

Base Information Edit

Chemical Name:3-(Hexadecanoyloxy)-4-phenyl-1,3-thiazole-2(3H)-thione
CAS No.:106130-34-1
Molecular Formula:C25H37NO2S2
Molecular Weight:447.706
Hs Code.:
DSSTox Substance ID:DTXSID60544091
Wikidata:Q82421077
Mol file:106130-34-1.mol

Synonyms:106130-34-1;SCHEMBL10396506;3-(Hexadecanoyloxy)-4-phenyl-1,3-thiazole-2(3H)-thione;DTXSID60544091

Suppliers and Price of 3-(Hexadecanoyloxy)-4-phenyl-1,3-thiazole-2(3H)-thione

Supply Marketing:Edit

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

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Chemical Property of 3-(Hexadecanoyloxy)-4-phenyl-1,3-thiazole-2(3H)-thione Edit

Chemical Property:

XLogP3:10.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:17
Exact Mass:447.22657177
Heavy Atom Count:30
Complexity:529

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCCCCCCCCCC(=O)ON1C(=CSC1=S)C2=CC=CC=C2

Technology Process of 3-(Hexadecanoyloxy)-4-phenyl-1,3-thiazole-2(3H)-thione

There total 4 articles about 3-(Hexadecanoyloxy)-4-phenyl-1,3-thiazole-2(3H)-thione 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: 92.0%

: 104942-45-2
4-phenyl-3-hydroxythiazole-2(3H)-thione

: 112-67-4
n-hexadecanoyl chloride

: 106130-34-1
3-palmitoyloxy-4-phenylthiazolin-2(3H)-thione

Guidance literature:: With pyridine; dmap; In diethyl ether; for 0.333333h; Ambient temperature;

Reference yield:

: 14181-72-7,17082-13-2,17082-14-3
2-bromo-1-phenyl-ethanone oxime

: 106130-34-1
3-palmitoyloxy-4-phenylthiazolin-2(3H)-thione

Guidance literature:: Multi-step reaction with 3 steps

1: 90 percent / acetone / 4 h / Ambient temperature

2: 46 percent / anhydrous ZnCl₂ / diethyl ether / 12 h / Ambient temperature

3: 92 percent / pyridine, DMAP / diethyl ether / 0.33 h / Ambient temperature

With pyridine; dmap; zinc(II) chloride; In diethyl ether; acetone;

Reference yield:

: 104942-40-7
O-ethyl-S-(2-oximino-2-phenylethyl)dithiocarbonate

: 106130-34-1
3-palmitoyloxy-4-phenylthiazolin-2(3H)-thione

Guidance literature:: Multi-step reaction with 2 steps

1: 46 percent / anhydrous ZnCl₂ / diethyl ether / 12 h / Ambient temperature

2: 92 percent / pyridine, DMAP / diethyl ether / 0.33 h / Ambient temperature

With pyridine; dmap; zinc(II) chloride; In diethyl ether;