ChemicalBook > CAS DataBase List > 8-BROMO-2H-ISOQUINOLIN-1-ONE

8-BROMO-2H-ISOQUINOLIN-1-ONE

Product Name
8-BROMO-2H-ISOQUINOLIN-1-ONE
CAS No.
475994-60-6
Chemical Name
8-BROMO-2H-ISOQUINOLIN-1-ONE
Synonyms
8-Bromoisoquinolin-1-ol;8-Bromoisoquinolin-1(2H);8-Bromoisoquinolin-1(2H)-one;8-BROMO-2H-ISOQUINOLIN-1-ONE;8-Bromo-1(2H)-isoquinolinone;8-BroMo-2H-isoquinoline-1-one;8-Bromo-1-hydroxyisoquinoline;1(2H)-Isoquinolinone, 8-bromo-;8-bromo-1(2H)-isoquinolin-1-one
CBNumber
CB62466376
Molecular Formula
C9H6BrNO
Formula Weight
224.05
MOL File
475994-60-6.mol
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8-BROMO-2H-ISOQUINOLIN-1-ONE Property

Boiling point:
446.1±45.0 °C(Predicted)
Density 
1.620±0.06 g/cm3 (20 ºC 760 Torr)
storage temp. 
2-8°C
pka
11.81±0.20(Predicted)
form 
powder
color 
Yellow
InChI
InChI=1S/C9H6BrNO/c10-7-3-1-2-6-4-5-11-9(12)8(6)7/h1-5H,(H,11,12)
InChIKey
NQMZAFRCYDJSEU-UHFFFAOYSA-N
SMILES
C1(=O)C2=C(C=CC=C2Br)C=CN1
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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

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

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

TRC
Product number
B688673
Product name
8-Bromo-2H-isoquinolin-1-one
Packaging
250mg
Price
$75
Updated
2021/12/16
SynQuest Laboratories
Product number
4H01-9-26
Product name
8-Bromo-1-hydroxyisoquinoline
Packaging
100mg
Price
$34
Updated
2021/12/16
Frontier Specialty Chemicals
Product number
G14306
Product name
8-Bromoisoquinolin-1-ol
Packaging
1g
Price
$50
Updated
2021/12/16
SynQuest Laboratories
Product number
4H01-9-26
Product name
8-Bromo-1-hydroxyisoquinoline
Packaging
500mg
Price
$135
Updated
2021/12/16
Frontier Specialty Chemicals
Product number
G14306
Product name
8-Bromoisoquinolin-1-ol
Packaging
5g
Price
$160
Updated
2021/12/16
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8-BROMO-2H-ISOQUINOLIN-1-ONE Chemical Properties,Usage,Production

Synthesis

475994-58-2

475994-60-6

The general procedure for the synthesis of 8-bromoisoquinolin-1(2H)-one from 8-bromoisoquinoline 2-oxide was as follows: 8-bromoisoquinoline 2-oxide (630 mg, 2.8 mmol) was suspended in N,N-dimethylformamide (DMF, 10 mL), and treated with trifluoroacetic anhydride (4 mL). The reaction mixture was stirred overnight at room temperature until the solution was clarified. Subsequently, the reaction solution was concentrated under reduced pressure to remove the solvent. The residue was neutralized with dilute aqueous sodium carbonate and extracted several times with a 5% methanol/dichloromethane mixture. The organic phases were combined, washed with saturated aqueous sodium chloride solution, dried over anhydrous sodium sulfate and concentrated under reduced pressure. The crude product was purified by silica gel column chromatography, eluting with a gradient of 0-10% methanol in dichloromethane solution to give a white solid product (180 mg, 29% yield). Mass spectrometric analysis (positive ion electrospray mode) showed m/z 225 [M+H]+.

References

[1] Patent: WO2004/2992, 2004, A1. Location in patent: Page 76; 77
[2] Tetrahedron, 2002, vol. 58, # 29, p. 5761 - 5766
[3] Patent: WO2017/100591, 2017, A1. Location in patent: Paragraph 00226

8-BROMO-2H-ISOQUINOLIN-1-ONE Preparation Products And Raw materials

Raw materials

Preparation Products

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8-BROMO-2H-ISOQUINOLIN-1-ONE Suppliers

Nanjing Asfam Pharmaceutical Technology Co., Ltd.
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025-58867862 18751812725
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02558867862
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sales@ace-pharm.com
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China
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J & K SCIENTIFIC LTD.
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18210857532; 18210857532
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86-10-82849933
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jkinfo@jkchemical.com
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China
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WUHAN SUN-SHINE BIO-TECHNOLOGY Co., Ltd.
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17702719238 18971495150;
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sales@sun-shinechem.com
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China
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Shanghai Hanhong Scientific Co.,Ltd.
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021-54306202 13764082696
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info@hanhongsci.com
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China
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Shanghai Sunway Pharmaceutical Technology Co., Ltd
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18270980682
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021 51613951
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mlcheng@sunwaypharm.cn
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China
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Shanghai Topbiochem Technology Co., Ltd
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China
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SynAsst Chemical.
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Chengdu AstaTech Trading Co., Ltd./AstaTech (Chengdu) Pharma. Co., Ltd.
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+86-28-85122536 85324413
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+86-28-85326443
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market@astatech.cn
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China
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Shanghai ChriChem Co., Ltd.
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021-54880687
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021-54880687
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China
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Bide Pharmatech Ltd.
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400-164-7117 13681763483
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+86-21-61629029
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product02@bidepharm.com
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China
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42446
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View Lastest Price from 8-BROMO-2H-ISOQUINOLIN-1-ONE manufacturers

Career Henan Chemical Co
Product
8-BROMO-2H-ISOQUINOLIN-1-ONE 475994-60-6
Price
US $1.00/KG
Min. Order
1KG
Purity
99.0%
Supply Ability
100kg
Release date
2020-01-07