Basic information Safety Supplier Related

5-BROMO-2,1,3-BENZOTHIADIAZOLE

Basic information Safety Supplier Related

5-BROMO-2,1,3-BENZOTHIADIAZOLE Basic information

Product Name:
5-BROMO-2,1,3-BENZOTHIADIAZOLE
Synonyms:
  • 5-BROMO-2,1,3-BENZOTHIADIAZOLE
  • 5-BROMO-BENZO[1,2,5]THIADIAZOLE
  • BUTTPARK 95\50-70
  • 5-Bromo-benzo[2,1,3]thiadiazole
  • 5-Bromobenzo[c][1,2,5]thiadiazole
  • 2,1,3-Benzothiadiazole, 5-bromo-
CAS:
1753-75-9
MF:
C6H3BrN2S
MW:
215.07
Product Categories:
  • Heterocycles series
Mol File:
1753-75-9.mol
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5-BROMO-2,1,3-BENZOTHIADIAZOLE Chemical Properties

Melting point:
55-60 °C
Boiling point:
272.2±13.0 °C(Predicted)
Density 
1.859±0.06 g/cm3(Predicted)
storage temp. 
2-8°C
form 
Solid
pka
-0.73±0.36(Predicted)
Appearance
Light brown to gray Solid
CAS DataBase Reference
1753-75-9
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Safety Information

Hazard Codes 
Xi,Xn
Risk Statements 
36/37/38-36-22
Safety Statements 
26-36/37/39-37/39
WGK Germany 
3
HazardClass 
IRRITANT
HS Code 
2934999090
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5-BROMO-2,1,3-BENZOTHIADIAZOLE Usage And Synthesis

Synthesis

1575-37-7

1753-75-9

Example 2 Synthesis of 5-bromo-2,1,3-benzothiadiazole: A reaction mixture was prepared by mixing 4.0 g (21 mmol) of 4-bromophthalimide, 14 mL of thionyl chloride and 0.62 mL of concentrated sulfuric acid. The mixture was heated to reflux for 1 hour. Upon completion of the reaction, the mixture was cooled and subsequently slowly poured into ice water. The precipitate precipitated was collected by filtration and washed with plenty of water until the washings were neutral. Finally, the precipitate was thoroughly dried to give 4.5 g of 5-bromo-2,1,3-benzothiadiazole crude product (melting point 48 to 50 °C, yield 96.5%).

References

[1] RSC Advances, 2016, vol. 6, # 71, p. 66978 - 66989
[2] Patent: US2009/149676, 2009, A1. Location in patent: Page/Page column 5
[3] ChemMedChem, 2018, vol. 13, # 21, p. 2332 - 2348
[4] Chemistry of Heterocyclic Compounds (New York, NY, United States), 1967, vol. 3, p. 662 - 666
[5] Khimiya Geterotsiklicheskikh Soedinenii, 1967, vol. 3, # 5, p. 839 - 844

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