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Dehydroaripiprazole

Base Information Edit
  • Chemical Name:Dehydroaripiprazole
  • CAS No.:129722-25-4
  • Molecular Formula:C23H25Cl2N3O2
  • Molecular Weight:446.376
  • Hs Code.:2933790002
  • European Community (EC) Number:802-933-6
  • UNII:2S514OZH3B
  • DSSTox Substance ID:DTXSID70156225
  • Nikkaji Number:J2.189.110J
  • Wikidata:Q27255535
  • Pharos Ligand ID:NY18V5SF8YZ6
  • ChEMBL ID:CHEMBL161792
  • Mol file:129722-25-4.mol
Dehydroaripiprazole

Synonyms:dehydro-aripiprazole;dehydroaripiprazole

Suppliers and Price of Dehydroaripiprazole
Supply Marketing:Edit
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
  • Usbiological
  • Dehydro Aripiprazole
  • 5mg
  • $ 460.00
  • TRC
  • DehydroAripiprazole
  • 25mg
  • $ 550.00
  • TRC
  • DehydroAripiprazole
  • 100mg
  • $ 1705.00
  • Sigma-Aldrich
  • Dehydro aripiprazole solution
  • 25mg
  • $ 1260.00
  • Sigma-Aldrich
  • Aripiprazole Related Compound G Pharmaceutical Secondary Standard; Certified Reference Material
  • 100MG
  • $ 449.00
  • Sigma-Aldrich
  • Dehydro aripiprazole solution 1.0?mg/mL in methanol with 5% 1 M HCl, ampule of 1?mL, certified reference material, Cerilliant?
  • 1 mL
  • $ 203.00
  • Sigma-Aldrich
  • Dehydro aripiprazole solution 1.0 mg/mL in methanol with 5% 1 M HCl, ampule of 1 mL, certified reference material
  • 053-1ml
  • $ 197.00
  • Medical Isotopes, Inc.
  • Dehydroaripiprazole 99%
  • 5 mg
  • $ 390.00
  • Matrix Scientific
  • 7-(4-(4-(2,3-Dichlorophenyl)piperazin-1-yl)butoxy)quinolin-2(1H)-one 95+%
  • 1g
  • $ 1647.00
  • Matrix Scientific
  • 7-(4-(4-(2,3-Dichlorophenyl)piperazin-1-yl)butoxy)quinolin-2(1H)-one 95+%
  • 250mg
  • $ 742.00
Total 27 raw suppliers
Chemical Property of Dehydroaripiprazole Edit
Chemical Property:
  • Boiling Point:654.375 °C at 760 mmHg 
  • PKA:11.22±0.70(Predicted) 
  • Flash Point:349.554 °C 
  • PSA:48.57000 
  • Density:1.282 g/cm3 
  • LogP:4.81900 
  • Storage Temp.:?20°C 
  • Solubility.:Chloroform (Slightly), Methanol (Slightly, Heated) 
  • XLogP3:4.9
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Rotatable Bond Count:7
  • Exact Mass:445.1323824
  • Heavy Atom Count:30
  • Complexity:597
Purity/Quality:

98%,99%, *data from raw suppliers

Dehydro Aripiprazole *data from reagent suppliers

Safty Information:
  • Pictogram(s): F,T 
  • Hazard Codes:F,T 
  • Statements: 11-23/24/25-39/23/24/25-52/53 
  • Safety Statements: 16-36/37-45-61 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:C1CN(CCN1CCCCOC2=CC3=C(C=C2)C=CC(=O)N3)C4=C(C(=CC=C4)Cl)Cl
  • Uses Dehydro Aripiprazole (Aripiprazole EP Impurity E; Aripiprazole USP Related Compound G) is an impurity of Aripiprazole (A771000), a selective dopamine D2-receptor antagonist with dopamine autoreceptor agonist activity.
Technology Process of Dehydroaripiprazole

There total 5 articles about Dehydroaripiprazole 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:
Guidance literature:
aripiprazole; With trifluoroacetic acid; 2,3-dicyano-5,6-dichloro-p-benzoquinone; In tetrahydrofuran; at 20 ℃; for 0.666667h; Inert atmosphere; large scale reaction;
With sodium hydroxide; In tetrahydrofuran; water; pH=12;
Guidance literature:
With triethylamine; sodium iodide; In acetonitrile; for 4h; Heating;
DOI:10.1021/jm940608g
Guidance literature:
7–(4-bromobutoxy)quinolin-2(1H)-one; With sodium iodide; In acetonitrile; at 20 ℃; for 0.5h; Heating / reflux;
1-(2,3-dichlorophenyl)-piperazine hydrochloride; With triethylamine; In acetonitrile; at 20 ℃; for 3h; Heating / reflux;
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