Phenyl tribromomethyl sulfone Chemical Properties

Melting point:

145-147 °C(lit.)

Boiling point:

373.8±42.0 °C(Predicted)

Density 

2.300±0.06 g/cm3(Predicted)

storage temp. 

Sealed in dry,Room Temperature

solubility 

soluble in Acetone

form 

powder to crystal

color 

White to Almost white

InChI

InChI=1S/C7H5Br3O2S/c8-7(9,10)13(11,12)6-4-2-1-3-5-6/h1-5H

InChIKey

DWWMSEANWMWMCB-UHFFFAOYSA-N

SMILES

C1(S(C(Br)(Br)Br)(=O)=O)=CC=CC=C1

CAS DataBase Reference

17025-47-7(CAS DataBase Reference)

EPA Substance Registry System

Benzene, [(tribromomethyl)sulfonyl]- (17025-47-7)

Safety Information

Hazard Codes 

Xi

Risk Statements 

36/37/38

Safety Statements 

26-36

WGK Germany 

3

HS Code 

2930.90.2900

MSDS

• Language:English Provider:SigmaAldrich

Phenyl tribromomethyl sulfone Usage And Synthesis

Uses

The derivatives of phenyl tribromomethyl sulfone as novel compounds with potential pesticidal activity

Synthesis

General procedure: The NaOH solution (15% w/w, 8 mL) was cooled to 5 °C and Br2 (0.4 mL, 15 mmol, 3 eq.) was added dropwise while keeping the temperature of the mixture below 10 °C. The NaOH solution was cooled to 5 °C and Br2 (0.4 mL, 15 mmol, 3 eq.) was added to the mixture. Subsequently, phenylmethyl sulfone (5 mmol, 1 eq.) was added all at once. The reaction mixture was stirred at 75 °C for the indicated time (see Table 1). After completion of the reaction, the mixture was cooled to room temperature, the precipitate was collected by filtration, washed with H2O, dried in air and finally recrystallized by 2-PrOH. Detailed characterization data of the resulting tribromomethyl phenyl sulfone are given in the Supplementary Material.

References

[1] Journal of Organic Chemistry, 1986, vol. 51, # 17, p. 3369 - 3371
[2] Tetrahedron Letters, 2012, vol. 53, # 48, p. 6606 - 6610,5

Phenyl tribromomethyl sulfone(17025-47-7)Related Product Information

• Dimethyl sulfone
• PHENYL VALERATE
• Dimethyl sulfoxide
• Benzyl bromide
• 5-Methyl-1H-benzotriazole
• Tetradifon
• Benzotrifluoride
• 3-(Trifluoromethyl)benzaldehyde
• Diphenyl ether
• 4-Bromomethylbenzoic acid
• PHENYL RESIN
• Phenylacetic acid
• Bromoform
• BROMOMETHYL PHENYL SULFONE
• BROMOMETHYL PHENYL SULFIDE
• Phenyl tribromomethyl sulfone