Benproperine, (S)-

Base Information

Chemical Name:Benproperine, (S)-
CAS No.:124700-66-9
Molecular Formula:C21H27NO
Molecular Weight:309.44500
Hs Code.:
UNII:9P1NT3465X
Wikidata:Q27147798
Mol file:124700-66-9.mol

Synonyms:(+)-benproperine;(-)-benproperine;(R)-benproperine;(S)-benproperine;1-((1R)-1-methyl-2-(2-(phenylmethyl)phenoxy)ethyl)-piperidine;1-((1S)-1-methyl-2-(2-(phenylmethyl)phenoxy)ethyl)-piperidine;1-(1-methyl-2-(2-(phenylmethyl)phenoxy)ethyl)-piperidine and 4,4'-methylenebis(3-hydroxy-2-naphthalenecarboxylate) (2:1);1-(2-(2-benzylphenoxy)-1-methylethyl)piperidine;1-(2-(2-benzylphenoxy)-1-methylethyl)piperidine monophosphate;1-(o-benzylphenoxy)-2-piperidinopropane phosphate;ASA 158-5;ASA 158-5 free base;ASA-158-5;ASA-158-5 free base;ASA-1585 pamoate;benproperine;benproperine embonate;benproperine pamoate;benproperine phosphate;benproperine trihydrogen phosphate;benproperine, (+)-;benproperine, (-)-;benproperine, (R)-;benproperine, (S)-;Cofrel;piperidine, 1-((1R)-1-methyl-2-(2-(phenylmethyl)phenoxy)ethyl)-;piperidine, 1-((1S)-1-methyl-2-(2-(phenylmethyl)phenoxy)ethyl)-;pirexyl;Tussafug

Suppliers and Price of Benproperine, (S)-

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 Benproperine, (S)-

Chemical Property:

PSA：12.47000
LogP:4.46850
XLogP3:5.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:309.209264485
Heavy Atom Count:23
Complexity:320

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(COC1=CC=CC=C1CC2=CC=CC=C2)N3CCCCC3
Isomeric SMILES:C[C@@H](COC1=CC=CC=C1CC2=CC=CC=C2)N3CCCCC3

Technology Process of Benproperine, (S)-

There total 14 articles about Benproperine, (S)- 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: 72.4%

: 110-89-4
piperidine

: (S)-(-)-1-(2-benzylphenoxy)propan-2-yl 4-methylbenzenesulfonate

: 124700-66-9
(R)-(+)-1-[1-(2-benzylphenoxy)propan-2-yl]piperidine

Guidance literature:: at 120 ℃; for 5h;

Reference yield: 65.9%

: 110-89-4
piperidine

: (R)-(+)-1-(2-benzylphenoxy)propan-2-yl 4-methylbenzenesulfonate

: 124700-66-9
(S)-(-)-1-[1-(2-benzylphenoxy)propan-2-yl]piperidine

Guidance literature:: at 120 ℃; for 5h;

Reference yield: 49.0%

: 1-(3-(2-benzylphenoxy)-2-chloropropyl)piperidine

: 2156-27-6,124700-66-9
1-[1-methyl-2-[2-(phenylmethyl)phenoxy]ethyl]piperidine

Guidance literature:: 1-(3-(2-benzylphenoxy)-2-chloropropyl)piperidine; With sodium iodide; In acetonitrile; at 20 ℃; for 18h; Sealed tube; Inert atmosphere;

With lithium aluminium tetrahydride; In tetrahydrofuran; acetonitrile; at 0 ℃; for 0.0833333h; Sealed tube; Inert atmosphere;
DOI:10.1002/anie.202005652