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145369-94-4

145369-94-4 Structure

145369-94-4 Structure
IdentificationBack Directory
[Name]

6-BROMO-4-HYDROXYQUINOLINE
[CAS]

145369-94-4
[Synonyms]

SKL324
BUTTPARK 23\09-03
6-BROMOQUINOLIN-4-OL
6-BROMO-4-QUINOLINOL
6-BROMOQUINOLIN-4-ONE
4-Quinolinol, 6-bromo-
6-BROMO-4(1H)-QUINOLONE
6-BROMO-4-HYDROXYQUINOLINE
4-HYDROXY-6-BROMOQUINOLINE
6-bromo-4-hyrdroxyquinoline
4,7-DICHLORO-8-METHYLQUINOLINE
6-Bromo-4-hydroxyquinoline ,98%
6-BROMO-4-HYDROXYQUINOLINE ISO 9001:2015 REACH
6-broMoquinolin-4-ol、6-BroMo-4-hydroxyquinoline
[EINECS(EC#)]

-0
[Molecular Formula]

C9H6BrNO
[MDL Number]

MFCD00272435
[MOL File]

145369-94-4.mol
[Molecular Weight]

224.05
Chemical PropertiesBack Directory
[Melting point ]

283°C(lit.)
[Boiling point ]

370.7±22.0 °C(Predicted)
[density ]

1.705±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[form ]

powder to crystal
[pka]

3.83±0.40(Predicted)
[color ]

White to Light yellow
[InChI]

InChI=1S/C9H6BrNO/c10-6-1-2-8-7(5-6)9(12)3-4-11-8/h1-5H,(H,11,12)
[InChIKey]

XKLBNOHKHRAXKK-UHFFFAOYSA-N
[SMILES]

N1C2C(=CC(Br)=CC=2)C(O)=CC=1
Safety DataBack Directory
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

22-36/37/38
[Safety Statements ]

26-36/37/39
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29334900
Hazard InformationBack Directory
[Chemical Properties]

Tan powder
[Synthesis]

6-BROMO-4-HYDROXYQUINOLINE-3-CARBOXYLIC ACID

98948-95-9

6-BROMO-4-HYDROXYQUINOLINE

145369-94-4

4.1.7 Synthesis of 6-bromoquinolin-4-ol (10): 6-bromo-4-hydroxyquinoline-3-carboxylic acid (9) (5.0 g, 18.73 mmol) was placed in a 100 mL round-bottomed flask and diphenyl ether (Ph2O, 30 mL) was added. The reaction mixture was stirred at 260 °C for 2 hours. After completion of the reaction, it was cooled to 60 °C and petroleum ether (30 mL) was added to precipitate the product. The suspended solid was collected by filtration and washed sequentially with petroleum ether and ethyl acetate (EtOAc). Finally, the product was dried under reduced pressure to afford the title compound 6-bromoquinolin-4-ol (10) (3.21 g, 14.39 mmol, 77% yield) as a brown solid.ESI-MS: m/z = 224 [M + H]+.

[References]

[1] ChemMedChem, 2015, vol. 10, # 5, p. 836 - 849
[2] Patent: US2006/63805, 2006, A1. Location in patent: Page/Page column 9
[3] Patent: WO2012/116237, 2012, A2. Location in patent: Page/Page column 120
[4] Patent: US2015/320727, 2015, A1. Location in patent: Paragraph 0557; 0558
[5] European Journal of Medicinal Chemistry, 2015, vol. 99, p. 36 - 50
Spectrum DetailBack Directory
[Spectrum Detail]

6-BROMO-4-HYDROXYQUINOLINE(145369-94-4)1HNMR
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