ChemicalBook--->CAS DataBase List--->17497-85-7

17497-85-7

17497-85-7 Structure

17497-85-7 Structure
IdentificationBack Directory
[Name]

TribroMocyanuric acid
[CAS]

17497-85-7
[Synonyms]

TribroMocyanuric acid
1,3,5-TribroMo-1,3,5-triazinane-2,4,6-trione
1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1,3,5-tribromo-
[Molecular Formula]

C3Br3N3O3
[MDL Number]

MFCD21604032
[MOL File]

17497-85-7.mol
[Molecular Weight]

365.762
Chemical PropertiesBack Directory
[Boiling point ]

324.3±25.0 °C(Predicted)
[density ]

3.259±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[pka]

-4.49±0.20(Predicted)
[Appearance]

White to off-white Solid
[InChI]

InChI=1S/C3Br3N3O3/c4-7-1(10)8(5)3(12)9(6)2(7)11
[InChIKey]

ZKWDCFPLNQTHSH-UHFFFAOYSA-N
[SMILES]

N1(Br)C(=O)N(Br)C(=O)N(Br)C1=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H332-H335
[Precautionary statements ]

P280-P310-P305+P351+P338
Hazard InformationBack Directory
[Synthesis]

Cyanuric acid

108-80-5

TribroMocyanuric acid

17497-85-7

Cyanuric acid (5 g, 38.5 mmol) was dissolved in a slight excess of cooled 3 M NaOH aqueous solution at room temperature and the solution was transferred to a beaker. A solution of Br2 (3 mL, 58.4 mmol) dissolved in CCl4 (6 mL) was slowly added dropwise to the reaction mixture while stirring vigorously at 0°C. An orange colored precipitate was produced immediately during the reaction. The resulting solid product was isolated by filtration, washed several times with cold distilled water and subsequently dried in a vacuum drying oven for 18 hours. Ultimately, an orange crystalline solid 1,3,5-tribromo-1,3,5-triazine-2,4,6-trione was obtained in quantitative yield.

[References]

[1] Oriental Journal of Chemistry, 2015, vol. 31, # 3, p. 1565 - 1570
[2] Synlett, 2006, # 10, p. 1515 - 1518
[3] European Journal of Organic Chemistry, 2013, # 35, p. 8004 - 8013
[4] Arkivoc, 2016, vol. 2016, # 4, p. 193 - 203
[5] Tetrahedron Letters, 2011, vol. 52, # 18, p. 2288 - 2291
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