2-[(3-bromophenyl)methylsulfanyl]-1H-benzimidazole

Base Information

Chemical Name:2-[(3-bromophenyl)methylsulfanyl]-1H-benzimidazole
CAS No.:5571-61-9
Molecular Formula:C14H11BrN2S
Molecular Weight:319.2195
Hs Code.:
DSSTox Substance ID:DTXSID50971079
Wikidata:Q82954507

Synonyms:5571-61-9;Oprea1_646490;2-[(3-bromophenyl)methylsulfanyl]-1H-benzimidazole;DTXSID50971079;AKOS000275730;SR-01000421319;SR-01000421319-1;1H-Benzimidazole, 2-[[(3-bromophenyl)methyl]thio]-;2-{[(3-Bromophenyl)methyl]sulfanyl}-1H-benzimidazole;2-{[(3-BROMOPHENYL)METHYL]SULFANYL}-1H-1,3-BENZODIAZOLE

Suppliers and Price of 2-[(3-bromophenyl)methylsulfanyl]-1H-benzimidazole

Supply Marketing:

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

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Chemical Property of 2-[(3-bromophenyl)methylsulfanyl]-1H-benzimidazole

Chemical Property:

Vapor Pressure:3.51E-10mmHg at 25°C
Boiling Point:501.3°Cat760mmHg
Flash Point:257°C
Density:1.59g/cm³
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:317.98263
Heavy Atom Count:18
Complexity:277

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C2C(=C1)NC(=N2)SCC3=CC(=CC=C3)Br

Technology Process of 2-[(3-bromophenyl)methylsulfanyl]-1H-benzimidazole

There total 2 articles about 2-[(3-bromophenyl)methylsulfanyl]-1H-benzimidazole 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: 80.0%

: 5621-63-6
(2-amino-3,5-dichloro-phenyl)-phenyl-methanone

: 79-04-9
chloroacetyl chloride

: 5571-61-9
7,9-dichloro-5-phenyl-benzodiazepin-2-one

Guidance literature:: (2-amino-3,5-dichloro-phenyl)-phenyl-methanone; chloroacetyl chloride; With potassium carbonate; In tetrahydrofuran; at 0 ℃; for 0.5h;

With ammonium hydroxide; potassium carbonate; In tetrahydrofuran; at 20 ℃; for 15h; Further stages.;
DOI:10.1080/00397910701750078

Reference yield:

: 5571-61-9
7,9-dichloro-5-phenyl-benzodiazepin-2-one

Guidance literature:: 2-Amino-3.5-dichlor-benzophenon, Glycin-ethylester-hydrochlorid, Pyridin, Kochen;

Reference yield: 84.0%

: 41029-44-1
isopropyl triflate

: 5571-61-9
7,9-dichloro-5-phenyl-benzodiazepin-2-one

: 1248432-48-5
7,9-dichloro-1-isopropyl-5-phenyl-1H-benzo[e][1,4]diazepine-2(3H)-one

Guidance literature:: 7,9-dichloro-5-phenyl-benzodiazepin-2-one; With sodium hydride; In tetrahydrofuran; at 0 ℃; for 0.5h; Inert atmosphere;

isopropyl triflate; In tetrahydrofuran; at 20 ℃; for 6h; Inert atmosphere;
DOI:10.1021/jo1010608