(S)-1,3-dibenzylpiperazine

Base Information

Chemical Name:(S)-1,3-dibenzylpiperazine
CAS No.:204327-96-8
Molecular Formula:C18H22 N2
Molecular Weight:266.386
Hs Code.:2933599590
DSSTox Substance ID:DTXSID00445472
Wikidata:Q72463682
Mol file:204327-96-8.mol

Synonyms:(S)-1,3-dibenzylpiperazine;204327-96-8;(3S)-1,3-dibenzylpiperazine;(S)-N4-Benzyl-2-benzylpiperazine;1-benzyl-3(S)-benzylpiperazine;SCHEMBL18325;DTXSID00445472;AJNDRRBUHVZNKU-SFHVURJKSA-N;MFCD03787922;AKOS015897967;AS-47183;Piperazine,1,3-bis(phenylmethyl)-,(3S)-;CS-0183202;A26359;F12504

Suppliers and Price of (S)-1,3-dibenzylpiperazine

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

SynQuest Laboratories
(3S)-1,3-Dibenzylpiperazine
1 g
$ 352.00

American Custom Chemicals Corporation
(S)-1,3-DIBENZYLPIPERAZINE 95.00%
5G
$ 1790.25

American Custom Chemicals Corporation
(S)-1,3-DIBENZYLPIPERAZINE 95.00%
1G
$ 837.38

Alfa Aesar
(S)-1,3-Dibenzylpiperazine, 97%
1g
$ 523.00

Alfa Aesar
(S)-1,3-Dibenzylpiperazine, 97%
250mg
$ 176.00

Total 12 raw suppliers

Chemical Property of (S)-1,3-dibenzylpiperazine

Chemical Property:

Vapor Pressure:2.45E-06mmHg at 25°C
Boiling Point:391.5°C at 760 mmHg
PKA:9.25±0.40(Predicted)
Flash Point:149.1°C
PSA：15.27000
Density:1.064
LogP:2.96980
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:266.178298710
Heavy Atom Count:20
Complexity:267

Purity/Quality:

97% ^*data from raw suppliers

(3S)-1,3-Dibenzylpiperazine ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36/37/39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN(CC(N1)CC2=CC=CC=C2)CC3=CC=CC=C3
Isomeric SMILES:C1CN(C[C@@H](N1)CC2=CC=CC=C2)CC3=CC=CC=C3

Technology Process of (S)-1,3-dibenzylpiperazine

There total 18 articles about (S)-1,3-dibenzylpiperazine 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: 97.0%

: 169447-84-1
(3S)-1,3-dibenzylpiperazine-2,5-dione

: 204327-96-8
(3S)-1,3-dibenzylpiperazine

Guidance literature:: With lithium aluminium tetrahydride; In tetrahydrofuran; at 20 ℃; for 37h;
DOI:10.1021/jm990337f

Reference yield:

: [((S)-2-Amino-3-phenyl-propionyl)-benzyl-amino]-acetic acid ethyl ester

: 204327-96-8
(3S)-1,3-dibenzylpiperazine

Guidance literature:: Multi-step reaction with 2 steps

1: TEA / CH₂Cl₂ / 2 h / 20 °C

2: 97 percent / LiAlH₄ / tetrahydrofuran / 37 h / 20 °C

With lithium aluminium tetrahydride; TEA; In tetrahydrofuran; dichloromethane; 1: Cyclization / 2: Reduction;
DOI:10.1021/jm990337f

Reference yield:

: 211506-73-9
N^α-Boc-Phe-N^α-benzylglycine ethyl ester

: 204327-96-8
(3S)-1,3-dibenzylpiperazine

Guidance literature:: Multi-step reaction with 3 steps

1: TFA / CH₂Cl₂ / 1 h / 20 °C

2: TEA / CH₂Cl₂ / 2 h / 20 °C

3: 97 percent / LiAlH₄ / tetrahydrofuran / 37 h / 20 °C

With lithium aluminium tetrahydride; TEA; trifluoroacetic acid; In tetrahydrofuran; dichloromethane; 1: Deprotection / 2: Cyclization / 3: Reduction;
DOI:10.1021/jm990337f