4-BROMO-1(2H)-ISOQUINOLONE
- Product Name
- 4-BROMO-1(2H)-ISOQUINOLONE
- CAS No.
- 3951-95-9
- Chemical Name
- 4-BROMO-1(2H)-ISOQUINOLONE
- Synonyms
- 4-bromoisocarbostyril;4-Bromoisoquinolin-1-ol;4-BROMO-1(2H)-ISOQUINOLONE;4-BROMO-2H-ISOQUINOLIN-1-ONE;4-broMoisoquinolin-1(2H)-one;4-Bromo-1(2H)-isoquinolinone;4-BROMO-1-HYDROXYISOQUINOLINE;1(2H)-Isoquinolinone, 4-bromo-;4-Bromo-1(2H)-isoquinolone;4-bromo-1,2-dihydroisoquinolin-1-one
- CBNumber
- CB4757050
- Molecular Formula
- C9H6BrNO
- Formula Weight
- 224.05
- MOL File
- 3951-95-9.mol
4-BROMO-1(2H)-ISOQUINOLONE Property
- Melting point:
- 248-249 °C (decomp)(Solv: acetic acid (64-19-7); water (7732-18-5))
- Boiling point:
- 408.0±45.0 °C(Predicted)
- Density
- 1.666±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- form
- solid
- pka
- 11.91±0.40(Predicted)
- Appearance
- White to light brown Solid
- InChIKey
- ZOPUFLIYIMVOGZ-UHFFFAOYSA-N
N-Bromosuccinimide Price
- Product number
- SYX00211
- Product name
- 4-Bromo-1(2H)-isoquinolone
- Purity
- Aldrich
- Packaging
- 1g
- Price
- $497
- Updated
- 2025/07/31
- Product number
- B686918
- Product name
- 4-Bromoisoquinolin-1(2H)-one
- Packaging
- 50mg
- Price
- $60
- Updated
- 2021/12/16
- Product number
- FB54357
- Product name
- 4-Bromo-1-hydroxyisoquinoline
- Packaging
- 250mg
- Price
- $72.5
- Updated
- 2021/12/16
- Product number
- B881
- Product name
- 4-Bromo-1(2H)-isoquinolone
- Packaging
- 1g
- Price
- $108
- Updated
- 2021/12/16
- Product number
- FB54357
- Product name
- 4-Bromo-1-hydroxyisoquinoline
- Packaging
- 500mg
- Price
- $115
- Updated
- 2021/12/16
4-BROMO-1(2H)-ISOQUINOLONE Chemical Properties,Usage,Production
Synthesis
491-30-5
3951-95-9
General procedure for the synthesis of 4-bromo-1(2H)-isoquinolinone from 1-hydroxyisoquinoline: N-bromosuccinimide (NBS, 142 mg, 0.796 mmol) was added to a solution of DMF (2 mL) containing isoquinolin-1(2H)-one (105 mg, 0.723 mmol). The reaction mixture was stirred at room temperature for 2 hours. After completion of the reaction, the mixture was concentrated to remove the solvent. The crude product was purified by preparative high performance liquid chromatography (HPLC) to afford the intermediate 6 4-bromoisoquinolin-1(2H)-one (110 mg, 68% yield). [C] MS (ESI) m/z: 223.9 (M + H)+. 1H NMR (500 MHz, DMSO-d6) δ 11.57 (br.s, 1H), 8.24 (dd, J = 8.0, 0.8 Hz, 1H), 7.88-7.83 (m, 1H), 7.79-7.75 (m, 1H), 7.61 (ddd, J = 8.0, 7.1, 1.1 Hz, 1H), 7.55 (s, 1H).
References
[1] Journal of Medicinal Chemistry, 2014, vol. 57, # 4, p. 1299 - 1322
[2] Angewandte Chemie - International Edition, 2011, vol. 50, # 36, p. 8416 - 8419
[3] Synthetic Communications, 2007, vol. 37, # 23, p. 4199 - 4208
[4] Patent: US2014/206686, 2014, A1. Location in patent: Paragraph 0497-0499
[5] Patent: WO2016/69976, 2016, A1. Location in patent: Page/Page column 91
4-BROMO-1(2H)-ISOQUINOLONE Preparation Products And Raw materials
Raw materials
Preparation Products
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View Lastest Price from 4-BROMO-1(2H)-ISOQUINOLONE manufacturers
- Product
- 4-BROMO-1(2H)-ISOQUINOLONE 3951-95-9
- Price
- US $6.68/KG
- Min. Order
- 1KG
- Purity
- 97%-99%
- Supply Ability
- 1kg-1000kg
- Release date
- 2020-01-10