ChemicalBook > CAS DataBase List > 3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone

3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone

Product Name
3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone
CAS No.
129722-34-5
Chemical Name
3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone
Synonyms
CL041;Aripiprazol Intermediate;Aripiprazole Impurity i;Aripiprazole impurities1775;7-(4-bromobutoxy)-3,4-dihydro-;7-(4-BROMOBUTOXY)-3 4-DIHYDROCARBOSTYRYL;Aripiprazole Bromobutoxyquinoline Impurity;7-(4-BROMOBUTOXY)-3,4-DIHYDRO-2-QUINOLINONE;7-(4-Brombutoxy)-3,4-dihydrochinolin-2(1H)-on;7-(4-Bromobutoxy)-2(1h)-3,4-Dihydroquinolinone
CBNumber
CB8481674
Molecular Formula
C13H16BrNO2
Formula Weight
298.18
MOL File
129722-34-5.mol
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3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone Property

Melting point:
110-111°C
Boiling point:
463.4±45.0 °C(Predicted)
Density 
1.383±0.06 g/cm3(Predicted)
storage temp. 
Sealed in dry,Room Temperature
solubility 
Chloroform (Slightly), Methanol (Slightly)
pka
14.41±0.20(Predicted)
form 
powder to crystal
color 
White to Almost white
Stability:
Hygroscopic
InChI
InChI=1S/C13H16BrNO2/c14-7-1-2-8-17-11-5-3-10-4-6-13(16)15-12(10)9-11/h3,5,9H,1-2,4,6-8H2,(H,15,16)
InChIKey
URHLNHVYMNBPEO-UHFFFAOYSA-N
SMILES
N1C2=C(C=CC(OCCCCBr)=C2)CCC1=O
CAS DataBase Reference
129722-34-5(CAS DataBase Reference)
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Safety

HS Code 
2933499090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P271Use only outdoors or in a well-ventilated area.

P280Wear protective gloves/protective clothing/eye protection/face protection.

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N-Bromosuccinimide Price

TCI Chemical
Product number
B3333
Product name
7-(4-Bromobutoxy)-3,4-dihydro-2(1H)-quinolinone
Purity
>98.0%(HPLC)(N)
Packaging
1g
Price
$37
Updated
2025/07/31
TCI Chemical
Product number
B3333
Product name
7-(4-Bromobutoxy)-3,4-dihydro-2(1H)-quinolinone
Purity
>98.0%(HPLC)(N)
Packaging
5g
Price
$113
Updated
2025/07/31
TRC
Product number
B681960
Product name
7-(4-Bromobutoxy)-3,4-dihydroquinolin-2-one
Packaging
10g
Price
$215
Updated
2021/12/16
TRC
Product number
B681960
Product name
7-(4-Bromobutoxy)-3,4-dihydroquinolin-2-one
Packaging
100g
Price
$1165
Updated
2021/12/16
Ark Pharm
Product number
P000607276
Product name
7-(4-Bromobutoxy)-3,4-dihydroquinolin-2(1H)-one
Purity
97%
Packaging
250mg
Price
$5
Updated
2021/12/16
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3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone Chemical Properties,Usage,Production

Chemical Properties

White Solid

Uses

An impurity in the synthesis of Aripiprazole (A771000). A degradation product in Aripiprazole tablets.

Synthesis

110-52-1

22246-18-0

129722-34-5

Example-1: Preparation of 7-(4-bromobutoxy)-3,4-dihydroquinolone [BBQ] was carried out as follows: in a 3-liter, three-necked, round-bottomed flask equipped with a mechanical stirrer, a condenser, and a thermometer, 100 grams of 3,4-dihydro-7-hydroxy-2(1H)-quinolone, 397.5 grams of 1,4-dibromobutane, 42.33 grams of potassium carbonate, and 300 ml of N,N-dimethylformamide. After mixing with stirring at room temperature (30-35 °C), the reaction mixture was heated to 40-45 °C and maintained at this temperature for 1 hour. Subsequently, a second batch of potassium carbonate (42.33 g) was added and the reaction was continued at 40-45 °C for 1 hour. Next, a third batch of potassium carbonate (42.33 g) was added and the reaction was continued at the same temperature for 4-5 hours. After completion of the reaction, the mixture was cooled to room temperature, poured into 1500 ml of water and stirred for 30 minutes. Extraction was carried out by adding 500 ml of chloroform and the organic layer was washed with water after layering. The extraction was repeated once more with 500 ml of chloroform. The organic phases were combined and washed with 10% sodium hydroxide solution and after separating the layers, the chloroform layer was washed with 1500 ml of water. Subsequently, the organic solvent was removed by vacuum distillation. To remove the trace solvent, solvent exchange was performed with 2 x 250 ml of cyclohexane. To the residue, 300 ml of cyclohexane was added, stirred for 3 hours and filtered, and the solid was washed with 200 ml of cyclohexane. Finally, the product was dried in a disk dryer at 65-70 °C for 10-12 hours until the weight loss was less than 1%. The product was obtained as 148 g in 80.95% yield and 86.09% HPLC purity.

References

[1] Asian Journal of Chemistry, 2011, vol. 23, # 4, p. 1655 - 1660
[2] Arzneimittel-Forschung/Drug Research, 2006, vol. 56, # 10, p. 673 - 677
[3] Patent: WO2008/1188, 2008, A2. Location in patent: Page/Page column 8-9
[4] Journal of Medicinal Chemistry, 1998, vol. 41, # 5, p. 658 - 667
[5] Patent: US2006/79689, 2006, A1. Location in patent: Page/Page column 11

3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone Preparation Products And Raw materials

Raw materials

Preparation Products

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3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone Suppliers

Hangzhou Kaifei Chemical Co.,Ltd.
Tel
18067948953
Email
cedar@carefulpharm.com
Country
China
ProdList
33
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58
Hangzhou FST Pharmaceutical Co., Ltd
Tel
0571-88938669 18667135863
Email
wps@highfine.com
Country
China
ProdList
165
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60
J & K SCIENTIFIC LTD.
Tel
18210857532; 18210857532
Fax
86-10-82849933
Email
jkinfo@jkchemical.com
Country
China
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96815
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TCI (Shanghai) Development Co., Ltd.
Tel
021-67121386
Fax
021-67121385
Email
Sales-CN@TCIchemicals.com
Country
China
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24529
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81
Capot Chemical Co., Ltd
Tel
+86 (0) 571 85 58 67 18
Fax
0086-571-85864795
Country
China
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18207
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66
Jia Xing Isenchem Co.,Ltd
Tel
0573-85285100 18627885956
Fax
0573-85285100
Email
isenchem@163.com
Country
China
ProdList
9310
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66
Adamas Reagent, Ltd.
Tel
400-6009262 16621234537
Fax
021-64823266
Email
chenyj@titansci.com
Country
China
ProdList
14101
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59
Nanjing Chemlin Chemical Co., Ltd
Tel
025-83697070
Fax
+86-25-83453306
Email
info@chemlin.com.cn
Country
China
ProdList
15883
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64
Shanghai Hanhong Scientific Co.,Ltd.
Tel
021-54306202 13764082696
Email
info@hanhongsci.com
Country
China
ProdList
42934
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64
Chemsky(shanghai)International Co.,Ltd.
Tel
021-50135380
Email
shchemsky@sina.com
Country
China
ProdList
32321
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50
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View Lastest Price from 3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone manufacturers

Henan Aochuang Chemical Co.,Ltd.
Product
3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone 129722-34-5
Price
US $0.00-0.00/kg
Min. Order
1kg
Purity
98%
Supply Ability
1Ton
Release date
2022-09-26
Shaanxi Dideu New Materials Co. Ltd
Product
3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone 129722-34-5
Price
US $0.00/kg
Min. Order
1kg
Purity
99%
Supply Ability
10000KGS
Release date
2025-02-25
Hebei Zhanyao Biotechnology Co. Ltd
Product
3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone 129722-34-5
Price
US $10.00/IU
Min. Order
1KG
Purity
99%
Supply Ability
20 Tons
Release date
2021-10-14

129722-34-5, 3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinoneRelated Search:


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  • 7-(4-Bromobutoxy)-3,4-dihydro-2(1H)-quinolinoneQ: What is 7-(4-Bromobutoxy)-3,4-dihydro-2(1H)-quinolinone Q: What is the CAS Number of 7-(4-Bromobutoxy)-3,4-dihydro-2(1H)-quinolinone Q: What is the storage condition of 7-(4-Bromobutoxy)-3,4-dihydro-2(1H)-quinolinone Q: What are the applications of 7-(4-Bromobutoxy)-3,4-dihydro-2(1H)-quinolinone
  • TIANFU-CHEM - 3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone
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  • 7-(4-bromobutoxy)-1,2,3,4-tetrahydroquinolin-2-one, >99%
  • 129722-34-5
  • 29722-34-5
  • C13H16BrNO2
  • Aripiprazole
  • Aromatics
  • Heterocycles
  • Intermediates & Fine Chemicals
  • Pharmaceuticals
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  • INTERMEDIATESOFARIPIPRAZOLE