1-(2-Chlorophenyl)-1,4-diazepane

Base Information

Chemical Name:1-(2-Chlorophenyl)-1,4-diazepane
CAS No.:866555-51-3
Molecular Formula:C₁₁H₁₅ClN₂
Molecular Weight:210.706
Hs Code.:
DSSTox Substance ID:DTXSID60697935
Wikidata:Q82627974
Mol file:866555-51-3.mol

Synonyms:1-(2-CHLOROPHENYL)-1,4-DIAZEPANE;866555-51-3;1H-1,4-Diazepine,1-(2-chlorophenyl)hexahydro-;SCHEMBL3612685;DTXSID60697935;PUICLBZACXNDSP-UHFFFAOYSA-N;AKOS010941869;ETHYL2-HYDROXY-3-METHOXYBENZOATE;EN300-211606

Suppliers and Price of 1-(2-Chlorophenyl)-1,4-diazepane

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-(2-Chlorophenyl)-1,4-diazepane

Chemical Property:

PSA：15.27000
LogP:2.53350
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:210.0923762
Heavy Atom Count:14
Complexity:175

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CNCCN(C1)C2=CC=CC=C2Cl

Technology Process of 1-(2-Chlorophenyl)-1,4-diazepane

There total 3 articles about 1-(2-Chlorophenyl)-1,4-diazepane 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:

: 615-41-8
2-iodochlorobenzene

: 866555-51-3
1-(2-chlorophenyl)homopiperazine

Guidance literature:: Multi-step reaction with 2 steps

1: caesium carbonate; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene / 1,4-dioxane / 16 h / 110 °C / Inert atmosphere

2: hydrogenchloride / 1,4-dioxane / 16 h / 20 °C

With hydrogenchloride; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; caesium carbonate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; In 1,4-dioxane;

Reference yield:

: 615-41-8
2-iodochlorobenzene

: 91532-33-1
1-(3-Chloro-4-fluorophenyl)piperazine

: 866555-51-3
1-(2-chlorophenyl)homopiperazine

Guidance literature:: Multi-step reaction with 2 steps

1: tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; caesium carbonate / 1,4-dioxane / 16 h / 110 °C / Inert atmosphere

2: hydrogenchloride / 1,4-dioxane / 16 h / 20 °C

With hydrogenchloride; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; caesium carbonate; In 1,4-dioxane;