1',2',3',6'-Tetrahydro-[2,4']bipyridinyl

Base Information

Chemical Name:1',2',3',6'-Tetrahydro-[2,4']bipyridinyl
CAS No.:50461-51-3
Molecular Formula:C10H12N2
Molecular Weight:160.219
Hs Code.:2933399090
ChEMBL ID:CHEMBL278934
DSSTox Substance ID:DTXSID50569450
Wikidata:Q72505401
Mol file:50461-51-3.mol

Synonyms:50461-51-3;1',2',3',6'-Tetrahydro-[2,4']bipyridinyl;1',2',3',6'-tetrahydro-2,4'-bipyridine;2-(1,2,3,6-tetrahydropyridin-4-yl)pyridine;CHEMBL278934;SCHEMBL169400;DTXSID50569450;BDBM50026630;AKOS000205268;PD179128;EN300-49400;1'',2'',3'',6''-Tetrahydro-[2,4'']bipyridinyl

Suppliers and Price of 1',2',3',6'-Tetrahydro-[2,4']bipyridinyl

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

American Custom Chemicals Corporation
1',2',3',6'-TETRAHYDRO-[2,4']BIPYRIDINYL 95.00%
5MG
$ 498.82

Total 5 raw suppliers

Chemical Property of 1',2',3',6'-Tetrahydro-[2,4']bipyridinyl

Chemical Property:

PSA：24.92000
LogP:1.78710
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:160.100048391
Heavy Atom Count:12
Complexity:175

Purity/Quality:

97% ^*data from raw suppliers

1',2',3',6'-TETRAHYDRO-[2,4']BIPYRIDINYL 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CNCC=C1C2=CC=CC=N2

Technology Process of 1',2',3',6'-Tetrahydro-[2,4']bipyridinyl

There total 5 articles about 1',2',3',6'-Tetrahydro-[2,4']bipyridinyl 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: 92.0%

: 90606-77-2
3',6'-dihydro-2'H-[2,4']bipyridinyl-1'-carboxylic acid tert-butyl ester

: 50461-51-3
4-(pyridin-2-yl)-1,2,3,6-tetrahydropyridine

Guidance literature:: With trifluoroacetic acid; In dichloromethane; at 0 ℃; for 0.0833333h;
DOI:10.1021/jm00375a017

Reference yield:

: 109-04-6
2-bromo-pyridine

: 50461-51-3
4-(pyridin-2-yl)-1,2,3,6-tetrahydropyridine

Guidance literature:: Multi-step reaction with 3 steps

1: 1.) n-BuLi / 1.) Et₂O, hexane, -50 deg C, 10 min, 2.) Et₂O, hexane, -30 deg C, 1 h

2: 45 percent / methyl ester of (carboxysulfamoyl)triethylammonium hydroxide inner salt / benzene / 0.75 h / 50 °C

3: 92 percent / TFA / CH₂Cl₂ / 0.08 h / 0 °C

With n-butyllithium; methoxycarbonylsulfamoyl-triethylammmonium hydroxide; trifluoroacetic acid; In dichloromethane; benzene;
DOI:10.1021/jm00375a017

Reference yield:

: 41979-39-9
4-piperidone hydrochloride

: 50461-51-3
4-(pyridin-2-yl)-1,2,3,6-tetrahydropyridine

Guidance literature:: Multi-step reaction with 4 steps

1: 63 percent / Et₃N / dimethylformamide / 18 h / Ambient temperature

2: 1.) n-BuLi / 1.) Et₂O, hexane, -50 deg C, 10 min, 2.) Et₂O, hexane, -30 deg C, 1 h

3: 45 percent / methyl ester of (carboxysulfamoyl)triethylammonium hydroxide inner salt / benzene / 0.75 h / 50 °C

4: 92 percent / TFA / CH₂Cl₂ / 0.08 h / 0 °C

With n-butyllithium; methoxycarbonylsulfamoyl-triethylammmonium hydroxide; triethylamine; trifluoroacetic acid; In dichloromethane; N,N-dimethyl-formamide; benzene;
DOI:10.1021/jm00375a017