GBR 12935 dihydrochloride

Base Information

• Chemical Name: GBR 12935 dihydrochloride
• CAS No.: 67469-81-2
• Molecular Formula: C₂₈H₃₄N₂O*2ClH
• Molecular Weight: 487.513
• DSSTox Substance ID: DTXSID6042573
• Wikidata: Q27133024
• Metabolomics Workbench ID: 63140
• ChEMBL ID: CHEMBL1330764
• Mol file: 67469-81-2.mol

Synonyms:GBR 12935 dihydrochloride;67469-81-2;GBR-12935 dihydrochloride;GBR 12935 (dihydrochloride);1-[2-(Diphenylmethoxy)ethyl]-4-(3-phenylpropyl)piperazine dihydrochloride;1-(2-DIPHENYLMETHOXYETHYL)-4-(3-PHENYLPROPYL)PIPERAZINE DIHYDROCHLORIDE;67469-81-2 (HCl);GBR-12935 HCl;CHEBI:64091;1-(2-(Benzhydryloxy)ethyl)-4-(3-phenylpropyl)piperazine dihydrochloride;1-[2-(benzhydryloxy)ethyl]-4-(3-phenylpropyl)piperazine dihydrochloride;1-(2 (Diphenylmethoxy)ethyl)-4-(3-phenylpropyl)piperazine dihydrochloride;1-[2-(Diphenylmethoxy)ethyl]-4-(3-phenylpropyl)-piperazine dihydrochloride;1-[2-(diphenylmethoxy)ethyl]-4-(3-phenylpropyl)piperazinediium dichloride;SR-01000075429;MFCD00083175;GBR 12935 HCl;1-(2-Diphenylmethoxyethyl)-4-(3-phenylpropyl)piperazinedihydrochloride;EU-0100560;GBR12935dihydrochloride;SCHEMBL339982;CHEMBL1330764;DTXSID6042573;EX-A451;BCP09762;Tox21_500560;1-(2-benzhydryloxyethyl)-4-(3-phenylpropyl)piperazine;dihydrochloride;AKOS024458512;CCG-221864;CS-3130;LP00560;NCGC00093945-01;NCGC00261245-01;AC-35219;AS-58414;HY-12242;LS-111942;FT-0726457;G 9659;SR-01000075429-1;SR-01000075429-3;GBR 12935 dihydrochloride, >=98% (TLC), powder;Q27133024;1-(2-(BENZHYDRYLOXY)ETHYL)-4-(3-PHENYLPROPYL)PIPERAZINE 2HCl

Chemical Property of GBR 12935 dihydrochloride

Chemical Property:

• Vapor Pressure: 4.94E-13mmHg at 25°C
• Boiling Point: 564°C at 760 mmHg
• Flash Point: 294.9°C
• PSA: 15.71000
• LogP: 6.52280
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• Solubility.: H2O: 20 mg/mL with warming
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 10
• Exact Mass: 486.2204692
• Heavy Atom Count: 33
• Complexity: 440

Purity/Quality:

98%,99%, ^*data from raw suppliers

GBR 12935 dihydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1CCCC2=CC=CC=C2)CCOC(C3=CC=CC=C3)C4=CC=CC=C4.Cl.Cl
• Uses: A very potent and selective inhibitor of dopamine uptake

Technology Process of GBR 12935 dihydrochloride

There total 2 articles about GBR 12935 dihydrochloride 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:

GBR 12783 (145428-33-7) → {1-[2-(diphenylmethoxy)ethyl]-4-(3-phenyl-propyl)piperazine} dihydrochloride (67469-81-2)

Guidance literature:

With hydrogenchloride; hydrogen; palladium on activated charcoal; Multistep reaction; 1.) methanol, room temp., 2.) ether;

Reference yield:

→ {1-[2-(diphenylmethoxy)ethyl]-4-(3-phenyl-propyl)piperazine} dihydrochloride (67469-81-2)

Guidance literature:

upstream raw materials:

GBR 12783

Refernces

• 1、 -. "N-Benzhydryloxyethyl-N-phenylpropyl-piperazines". . . Retrieved 2008/06/13.