| Identification | More | [Name]
6-Bromo-2-chlorobenzothiazole | [CAS]
80945-86-4 | [Synonyms]
6-BROMO-2-CHLORO-1,3-BENZOTHIAZOLE
6-BROMO-2-CHLOROBENZO[D]THIAZOLE
6-BROMO-2-CHLOROBENZOTHIAZOLE
IFLAB-BB F1910-0018
Benzothiazole, 6-bromo-2-chloro- | [EINECS(EC#)]
627-810-2 | [Molecular Formula]
C7H3BrClNS | [MDL Number]
MFCD04971822 | [Molecular Weight]
248.53 | [MOL File]
80945-86-4.mol |
| Chemical Properties | Back Directory | [Melting point ]
99-103 °C | [Boiling point ]
157°C/18mmHg(lit.) | [density ]
1.849±0.06 g/cm3(Predicted) | [storage temp. ]
Keep in dark place,Sealed in dry,Room Temperature | [solubility ]
soluble in Toluene | [form ]
powder to crystal | [pka]
-0.87±0.10(Predicted) | [color ]
White to Orange to Green | [CAS DataBase Reference]
80945-86-4(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing . | [RIDADR ]
UN 2811 | [WGK Germany ]
3 | [Hazard Note ]
Irritant | [HazardClass ]
IRRITANT | [PackingGroup ]
Ⅲ | [HS Code ]
29342000 |
| Hazard Information | Back Directory | [Chemical Properties]
White solid | [Uses]
Starting material in a synthesis of benzothiazole dimers with high binding affinity to β-amyloid fibrils. | [Synthesis]
General procedure for the synthesis of 6-bromo-2-chlorobenzothiazole from 6-bromo-2-benzothiazolone: 6-bromo-2-benzothiazolone (500 mg, 2.2 mmol) was dissolved in phosphorus trichloride (5 mL) and the reaction was carried out at reflux for 18 hours. After completion of the reaction, the reaction mixture was slowly poured into ice water. The pH of the mixture was adjusted to 9 with ammonia to neutralize the reaction. The resulting solid product was collected by filtration, washed with water and dried under vacuum to afford 6-bromo-2-chlorobenzothiazole (450 mg, 83% yield). | [References]
[1] Patent: WO2007/146066, 2007, A2. Location in patent: Page/Page column 88-89
[2] Patent: US2015/368278, 2015, A1. Location in patent: Paragraph 1050 |
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