(3R,4S)-4-(4-chlorophenyl)-3-(iodomethyl)-1-methylpiperidine

Base Information

Chemical Name:(3R,4S)-4-(4-chlorophenyl)-3-(iodomethyl)-1-methylpiperidine
CAS No.:807342-01-4
Molecular Formula:C13H17ClIN
Molecular Weight:349.642
Hs Code.:
DSSTox Substance ID:DTXSID90459265
Wikidata:Q82282999

Synonyms:807342-01-4;(3R,4S)-4-(4-chlorophenyl)-3-(iodomethyl)-1-methylpiperidine;SCHEMBL1086538;DTXSID90459265

Suppliers and Price of (3R,4S)-4-(4-chlorophenyl)-3-(iodomethyl)-1-methylpiperidine

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
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Total 0 raw suppliers

Chemical Property of (3R,4S)-4-(4-chlorophenyl)-3-(iodomethyl)-1-methylpiperidine

Chemical Property:

XLogP3:4.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:349.00942
Heavy Atom Count:16
Complexity:216

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CCC(C(C1)CI)C2=CC=C(C=C2)Cl
Isomeric SMILES:CN1CC[C@@H]([C@H](C1)CI)C2=CC=C(C=C2)Cl

Technology Process of (3R,4S)-4-(4-chlorophenyl)-3-(iodomethyl)-1-methylpiperidine

There total 2 articles about (3R,4S)-4-(4-chlorophenyl)-3-(iodomethyl)-1-methylpiperidine 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%

: 263769-24-0
(+)-4β-(4-Chlorophenyl)-3α-(hydroxymethyl)-1-methylpiperidine

: 807342-01-4
(+)-(3R,4S)-4-(4-chlorophenyl)-3-(iodomethyl)-1-methylpiperidine

Guidance literature:: With 1H-imidazole; iodine; triphenylphosphine; In dichloromethane; for 2.5h; Heating;
DOI:10.1021/jm040117o

Reference yield:

: 263769-22-8,205805-13-6
(+)-methyl 4β-(4-chlorophenyl)-1-methylpiperidine-3α-carboxylate

: 807342-01-4
(+)-(3R,4S)-4-(4-chlorophenyl)-3-(iodomethyl)-1-methylpiperidine

Guidance literature:: Multi-step reaction with 2 steps

1: 92 percent / LiAlH₄ / tetrahydrofuran

2: 86 percent / Ph₃P; I₂; imidazole

With 1H-imidazole; lithium aluminium tetrahydride; iodine; triphenylphosphine; In tetrahydrofuran;
DOI:10.1016/j.bmcl.2006.03.066