1,3-Dihydro-6-chloro-1-(phenylmethyl)-2H-benzimidazol-2-one

Base Information

Chemical Name:1,3-Dihydro-6-chloro-1-(phenylmethyl)-2H-benzimidazol-2-one
CAS No.:79759-62-9
Molecular Formula:C14H11ClN2O
Molecular Weight:258.7029
Hs Code.:
DSSTox Substance ID:DTXSID901000711
Wikidata:Q82994412

Synonyms:BRN 5552735;79759-62-9;1,3-Dihydro-6-chloro-1-(phenylmethyl)-2H-benzimidazol-2-one;2H-Benzimidazol-2-one, 1,3-dihydro-6-chloro-1-(phenylmethyl)-;DTXSID901000711;1-Benzyl-6-chloro-1H-benzimidazol-2-ol;LS-33343

Suppliers and Price of 1,3-Dihydro-6-chloro-1-(phenylmethyl)-2H-benzimidazol-2-one

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of 1,3-Dihydro-6-chloro-1-(phenylmethyl)-2H-benzimidazol-2-one

Chemical Property:

Density:1.344g/cm³
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:258.0559907
Heavy Atom Count:18
Complexity:317

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)CN2C3=C(C=CC(=C3)Cl)NC2=O

Technology Process of 1,3-Dihydro-6-chloro-1-(phenylmethyl)-2H-benzimidazol-2-one

There total 9 articles about 1,3-Dihydro-6-chloro-1-(phenylmethyl)-2H-benzimidazol-2-one 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: 80.6%

: 79759-28-7
(2-Benzylamino-4-chloro-phenyl)-carbamic acid ethyl ester

: 79759-62-9
1-Benzyl-6-chloro-1,3-dihydro-benzoimidazol-2-one

Guidance literature:: With sodium ethanolate; In ethanol; for 3h; Heating;

Reference yield:

: 615-16-7
1,3-dihydro-2H-benzimidazol-2-one

: 79759-62-9
1-Benzyl-6-chloro-1,3-dihydro-benzoimidazol-2-one

Guidance literature:: Multi-step reaction with 6 steps

1: 94 percent / K₂CO₃ / acetonitrile / 0.5 h / Heating

2: 99 percent / SO₂Cl₂ / acetic acid / 1 h / 90 °C

3: 75 percent / DMAP / tetrahydrofuran / 0.33 h

4: i-PrNH₂ / tetrahydrofuran / 0.75 h

5: K₂CO₃ / acetonitrile / Heating

6: CF₃COOH

With dmap; sulfuryl dichloride; potassium carbonate; isopropylamine; trifluoroacetic acid; In tetrahydrofuran; acetic acid; acetonitrile;
DOI:10.1021/jo00111a014

Reference yield:

: 41120-23-4
ethyl 2-oxo-2,3-dihydro-1H-benzo[d]imidazole-1-carboxylate

: 79759-62-9
1-Benzyl-6-chloro-1,3-dihydro-benzoimidazol-2-one

Guidance literature:: Multi-step reaction with 5 steps

1: 99 percent / SO₂Cl₂ / acetic acid / 1 h / 90 °C

2: 75 percent / DMAP / tetrahydrofuran / 0.33 h

3: i-PrNH₂ / tetrahydrofuran / 0.75 h

4: K₂CO₃ / acetonitrile / Heating

5: CF₃COOH

With dmap; sulfuryl dichloride; potassium carbonate; isopropylamine; trifluoroacetic acid; In tetrahydrofuran; acetic acid; acetonitrile;
DOI:10.1021/jo00111a014