1-Propanol, 3-[[1-(2-methylphenyl)-1H-imidazol-2-yl]thio]-

Base Information

Chemical Name:1-Propanol, 3-[[1-(2-methylphenyl)-1H-imidazol-2-yl]thio]-
CAS No.:161190-54-1
Molecular Formula:C13H16N2OS
Molecular Weight:248.349
Hs Code.:
DSSTox Substance ID:DTXSID20446148
Nikkaji Number:J981.814F
Wikidata:Q82264734
Mol file:161190-54-1.mol

Synonyms:161190-54-1;1-Propanol, 3-[[1-(2-methylphenyl)-1H-imidazol-2-yl]thio]-;SCHEMBL9016906;DTXSID20446148;FAIJUROLQXGYLN-UHFFFAOYSA-N;3-(1-o-Tolyl-1H-imidazole-2-ylthio)-1-propanol;3-[1-(2-methylphenyl)-2-imidazolylthio]propanol

Suppliers and Price of 1-Propanol, 3-[[1-(2-methylphenyl)-1H-imidazol-2-yl]thio]-

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 1-Propanol, 3-[[1-(2-methylphenyl)-1H-imidazol-2-yl]thio]-

Chemical Property:

XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:248.09833431
Heavy Atom Count:17
Complexity:228

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=CC=C1N2C=CN=C2SCCCO

Technology Process of 1-Propanol, 3-[[1-(2-methylphenyl)-1H-imidazol-2-yl]thio]-

There total 3 articles about 1-Propanol, 3-[[1-(2-methylphenyl)-1H-imidazol-2-yl]thio]- 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: 99.8%

: 25372-14-9
N-(2-methylphenyl)-2-mercaptoimidazole

: 627-30-5
1-chloro-3-hydroxypropane

: 161190-54-1
3-(1-o-tolyl-1H-imidazol-2-ylsulfanyl)propan-1-ol

Guidance literature:: With sodium hydroxide; In isopropyl alcohol; for 2.5h; Heating;
DOI:10.1016/S0040-4020(01)00152-1

Reference yield:

: 614-69-7
2-tolyl isothiocyanate

: 161190-54-1
3-(1-o-tolyl-1H-imidazol-2-ylsulfanyl)propan-1-ol

Guidance literature:: Multi-step reaction with 2 steps

1.1: methanol / 1 h / 6 - 38 °C

1.2: 92.1 percent / conc. HCl / 1 h / 37 - 50 °C

2.1: 99.8 percent / aq. NaOH / propan-2-ol / 2.5 h / Heating

With sodium hydroxide; In methanol; isopropyl alcohol;
DOI:10.1016/S0040-4020(01)00152-1