Tert-butyl 4-(2-chlorophenoxy)piperidine-1-carboxylate

Base Information

Chemical Name:Tert-butyl 4-(2-chlorophenoxy)piperidine-1-carboxylate
CAS No.:552868-10-7
Molecular Formula:C16H22ClNO3
Molecular Weight:311.809
Hs Code.:2933399090
DSSTox Substance ID:DTXSID60587448
Wikidata:Q72456488
Mol file:552868-10-7.mol

Synonyms:552868-10-7;1-Boc-4-(2-Chlorophenoxy)piperidine;tert-butyl 4-(2-chlorophenoxy)piperidine-1-carboxylate;4-(2-Chloro-phenoxy)-piperidine-1-carboxylic acid tert-butyl ester;SCHEMBL68971;tert-Butyl4-(2-chlorophenoxy)piperidine-1-carboxylate;DTXSID60587448;QMADZUIDYBWTFY-UHFFFAOYSA-N;AMY18165;BCP23325;CXA86810;AKOS015900511;DB-071972;CS-0000009;E87973;4-(2-Chlorophenoxy)-piperidine-1-carboxylic acid tert-butyl ester

Suppliers and Price of Tert-butyl 4-(2-chlorophenoxy)piperidine-1-carboxylate

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

Crysdot
1-Boc-4-(2-Chlorophenoxy)piperidine 95+%
1g
$ 772.00

Chemenu
tert-butyl4-(2-chlorophenoxy)piperidine-1-carboxylate 95%
1g
$ 729.00

American Custom Chemicals Corporation
1-BOC-4-(2-CHLOROPHENOXY)PIPERIDINE 95.00%
5MG
$ 503.92

Alichem
1-Boc-4-(2-Chlorophenoxy)piperidine
1g
$ 640.56

Total 17 raw suppliers

Chemical Property of Tert-butyl 4-(2-chlorophenoxy)piperidine-1-carboxylate

Chemical Property:

Vapor Pressure:1.24E-06mmHg at 25°C
Boiling Point:400.8°C at 760 mmHg
PKA:-2.47±0.40(Predicted)
Flash Point:196.2°C
PSA：38.77000
Density:1.171g/cm³
LogP:4.05620
XLogP3:4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:311.1288213
Heavy Atom Count:21
Complexity:348

Purity/Quality:

97% ^*data from raw suppliers

1-Boc-4-(2-Chlorophenoxy)piperidine 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC=CC=C2Cl

Technology Process of Tert-butyl 4-(2-chlorophenoxy)piperidine-1-carboxylate

There total 3 articles about Tert-butyl 4-(2-chlorophenoxy)piperidine-1-carboxylate 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: 86.0%

: 95-57-8
2-monochlorophenol

: 109384-19-2
t-butyl 4-hydroxy piperidine-1-carboxylate

: 552868-10-7
4-(2-chloro-phenoxy)-piperidine-1-carboxylic acid tert-butyl ester

Guidance literature:: With di-isopropyl azodicarboxylate; triphenylphosphine; In tetrahydrofuran;
DOI:10.1016/j.bmcl.2008.06.088

Reference yield: 50.0%

: 95-57-8
2-monochlorophenol

: 141699-59-4
1-(tert-butoxycarbonyl)piperidin-4-yl methanesulfonate

: 552868-10-7
4-(2-chloro-phenoxy)-piperidine-1-carboxylic acid tert-butyl ester

Guidance literature:: With caesium carbonate; In N,N-dimethyl-formamide; at 65 ℃; for 7h;

Reference yield:

: 79099-07-3
N-tert-butyloxycarbonylpiperidin-4-one

: 552868-10-7
4-(2-chloro-phenoxy)-piperidine-1-carboxylic acid tert-butyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: sodium tetrahydroborate / methanol / 2 h / 0 °C

2: triphenylphosphine; diisopropyl (E)-azodicarboxylate / tetrahydrofuran / 0 - 20 °C

With sodium tetrahydroborate; diisopropyl (E)-azodicarboxylate; triphenylphosphine; In tetrahydrofuran; methanol;