1-(4-BroMobenzyl)-2-Mercapto-5-hydroxymethyliMidazole

Base Information

Chemical Name:1-(4-BroMobenzyl)-2-Mercapto-5-hydroxymethyliMidazole
CAS No.:312936-77-9
Molecular Formula:C11H11BrN2OS
Molecular Weight:299.191
Hs Code.:
DSSTox Substance ID:DTXSID20430865
Wikidata:Q82244602
Mol file:312936-77-9.mol

Synonyms:1-(4-BroMobenzyl)-2-Mercapto-5-hydroxymethyliMidazole;312936-77-9;3-[(4-bromophenyl)methyl]-4-(hydroxymethyl)-1H-imidazole-2-thione;2H-IMIDAZOLE-2-THIONE, 1-[(4-BROMOPHENYL)METHYL]-1,3-DIHYDRO-5-(HYDROXYMETHYL)-;SCHEMBL8171565;MYVCBVMUMOQADS-UHFFFAOYSA-;DTXSID20430865;MYVCBVMUMOQADS-UHFFFAOYSA-N;AMY32220;AKOS015489542;1-[(4-bromophenyl)methyl]-5-(hydroxymethyl)-2,3-dihydro-1H-imidazole-2-thione;InChI=1/C11H11BrN2OS/c12-9-3-1-8(2-4-9)6-14-10(7-15)5-13-11(14)16/h1-5,15H,6-7H2,(H,13,16)

Suppliers and Price of 1-(4-BroMobenzyl)-2-Mercapto-5-hydroxymethyliMidazole

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
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price

Total 1 raw suppliers

Chemical Property of 1-(4-BroMobenzyl)-2-Mercapto-5-hydroxymethyliMidazole

Chemical Property:

PSA：76.85000
LogP:2.47490
XLogP3:1.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:297.97755
Heavy Atom Count:16
Complexity:300

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1CN2C(=CNC2=S)CO)Br

Technology Process of 1-(4-BroMobenzyl)-2-Mercapto-5-hydroxymethyliMidazole

There total 3 articles about 1-(4-BroMobenzyl)-2-Mercapto-5-hydroxymethyliMidazole 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: 90.0%

: 62147-49-3
1,3-dihydroxyacetone dimer

: 333-20-0
potassium thioacyanate

: 26177-44-6
4-bromobenzylamine hydrochloride

: 312936-77-9
1-(4-Bromobenzyl)-2-Mercapto-5-Hydroxymethylimidazole

Guidance literature:: With acetic acid; In water; acetonitrile; at 55 ℃; for 18h; Further Variations:; Solvents; Product distribution;
DOI:10.1002/jhet.5570400206

Reference yield: 68.0%

: 96-26-4,26776-70-5
dihydroxyacetone

: 333-20-0
potassium thioacyanate

: 106-40-1
4-bromo-aniline

: 312936-77-9
1-(4-Bromobenzyl)-2-Mercapto-5-Hydroxymethylimidazole

Guidance literature:: 4-bromo-aniline; With hydrogenchloride; In acetonitrile; for 0.05h; Cooling with ice;

dihydroxyacetone; potassium thioacyanate; In propionic acid; acetonitrile; at 70 ℃; for 2h;
DOI:10.1016/j.bmcl.2013.03.062