4-[(2-Oxo-1,2,3,4-tetrahydroquinolin-7-yl)oxy]butanoic acid

Base Information

Chemical Name:4-[(2-Oxo-1,2,3,4-tetrahydroquinolin-7-yl)oxy]butanoic acid
CAS No.:58899-27-7
Molecular Formula:C13H15NO4
Molecular Weight:249.26200
Hs Code.:
European Community (EC) Number:891-767-8
UNII:9K3DEA9SHF
Mol file:58899-27-7.mol

Synonyms:58899-27-7;Aripiprazole Metabolite;4-[(2-oxo-1,2,3,4-tetrahydroquinolin-7-yl)oxy]butanoic acid;9K3DEA9SHF;4-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]butanoic acid;OPC-3373;4-((2-Oxo-3,4-dihydro-1H-quinolin-7-yl)oxy)butanoic acid;4-((1,2,3,4-Tetrahydro-2-oxo-7-quinolinyl)oxy)butanoic acid;4-((2-Oxo-1,2,3,4-tetrahydroquinolin-7-yl)oxy)butanoic acid;Butanoic acid, 4-((1,2,3,4-tetrahydro-2-oxo-7-quinolinyl)oxy)-;Aripiprazole metabolite (OPC-3373);Butanoic acid, 4-[(1,2,3,4-tetrahydro-2-oxo-7-quinolinyl)oxy]-;4-[(1,2,3,4-Tetrahydro-2-oxo-7-quinolinyl)oxy]butanoic acid;4-[(2-Oxo-3,4-dihydroquinolin-7(1H)-yl)oxy]butanoic Acid;UNII-9K3DEA9SHF;3,4-Dihydro-7-(3'carboxy)propoxy-2(1H)-quinolinone;SCHEMBL16059342;MFCD28118698;AKOS030631871;EN300-188172;3,4-Dihydro-7-(3-carboxy)propoxy-2(1H)-quinolinone;Aripiprazole metabolite (OPC-3373), 1mg/ml in Ethanol;Z1763357932

Suppliers and Price of 4-[(2-Oxo-1,2,3,4-tetrahydroquinolin-7-yl)oxy]butanoic acid

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

TRC
3,4-Dihydro-7-(3’carboxy)propoxy-2(1H)-quinolinone
500mg
$ 135.00

TRC
3,4-Dihydro-7-(3’carboxy)propoxy-2(1H)-quinolinone
5g
$ 1060.00

Chemenu
4-((2-Oxo-1,2,3,4-tetrahydroquinolin-7-yl)oxy)butanoicacid 97%
1g
$ 865.00

AK Scientific
4-[(2-Oxo-1,2,3,4-tetrahydroquinolin-7-yl)oxy]butanoicacid
500mg
$ 532.00

aablocks
AripiprazoleMetabolite
5g
$ 2288.00

aablocks
AripiprazoleMetabolite
1g
$ 788.00

Total 5 raw suppliers

Chemical Property of 4-[(2-Oxo-1,2,3,4-tetrahydroquinolin-7-yl)oxy]butanoic acid

Chemical Property:

Melting Point:216-218°C
PSA：75.63000
LogP:1.95290
Storage Temp.:Refrigerator
Solubility.:DMSO (Slightly, Heated), Methanol (Slightly, Heated)
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:249.10010796
Heavy Atom Count:18
Complexity:318

Purity/Quality:

> 95% ^*data from raw suppliers

3,4-Dihydro-7-(3’carboxy)propoxy-2(1H)-quinolinone ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC(=O)NC2=C1C=CC(=C2)OCCCC(=O)O
Uses 3,4-Dihydro-7-(3’carboxy)propoxy-2(1H)-quinolinone is a metabolite of Aripiprazole (A771000); a selective dopamine D2-receptor antagonist with dopamine autoreceptor agonist activity. Also an antipsychotic. Aripiprazole Butanoic Acid Impurity

Technology Process of 4-[(2-Oxo-1,2,3,4-tetrahydroquinolin-7-yl)oxy]butanoic acid

There total 3 articles about 4-[(2-Oxo-1,2,3,4-tetrahydroquinolin-7-yl)oxy]butanoic acid 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:

: C₁₄H₁₇NO₄

: 58899-27-7
4-(2-Oxo-1,2,3,4-tetrahydro-quinolin-7-yloxy)-butyric acid

Guidance literature:: With water; sodium hydroxide; In ethanol; at 20 ℃; for 12h;
DOI:10.1039/d0dt03194a

Reference yield:

: 22246-18-0
7-hydroxy-3,4-dihydro-2-(1H)-quinolinone

: 58899-27-7
4-(2-Oxo-1,2,3,4-tetrahydro-quinolin-7-yloxy)-butyric acid

Guidance literature:: Multi-step reaction with 2 steps

1.1: potassium carbonate; potassium iodide / N,N-dimethyl-formamide / 0.5 h

1.2: 24 h / 50 °C

2.1: sodium hydroxide; water / ethanol / 12 h / 20 °C

With water; potassium carbonate; potassium iodide; sodium hydroxide; In ethanol; N,N-dimethyl-formamide;
DOI:10.1039/d0dt03194a