ChemicalBook--->CAS DataBase List--->67927-44-0

67927-44-0

67927-44-0 Structure

67927-44-0 Structure
IdentificationBack Directory
[Name]

6-Bromo-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one
[CAS]

67927-44-0
[Synonyms]

6-bromo-3-methyl-1,3-benzoxazol-2-one
2(3H)-Benzoxazolone, 6-bromo-3-methyl-
6-Bromo-3-methylbenzo[d]oxazol-2(3H)-one
6-Bromo-3-methyl-1,3-benzoxazol-2(3H)-one, 97%
6-Bromo-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one
[Molecular Formula]

C8H6BrNO2
[MDL Number]

MFCD00694789
[MOL File]

67927-44-0.mol
[Molecular Weight]

228.04
Chemical PropertiesBack Directory
[Melting point ]

143-144 °C(Solv: hexane (110-54-3))
[Boiling point ]

298.2±42.0 °C(Predicted)
[density ]

1.710±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

Powder
[pka]

-1.30±0.20(Predicted)
[color ]

Off-white
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

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

P261-P280-P305+P351+P338
[HazardClass ]

IRRITANT
[HS Code ]

29349990
Spectrum DetailBack Directory
[Spectrum Detail]

6-Bromo-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one(67927-44-0)1HNMR
Hazard InformationBack Directory
[Synthesis]

6-BROMO-BENZOXAZOLINONE

19932-85-5

Iodomethane

74-88-4

6-Bromo-3-methyl-2,3-dihydro-1,3-benzoxazol-2-one

67927-44-0

Example 3: Scheme B2; To a solution of 6-bromobenzo[d]oxazol-2(3H)-one (1 eq., 23 mmol, 5.0 g) in acetone (230 ml) was sequentially added potassium carbonate (1.5 eq., 35 mmol, 5.0 g) and iodomethane (1.2 eq., 28 mmol, 4.0 g); The reaction mixture was stirred for 4 hours at room temperature. After completion of the reaction, the acetone solvent was partially concentrated under reduced pressure; the concentrated mixture was poured into 1N HCl aqueous solution and the precipitate was collected by filtration and washed sequentially with water, isopropanol and isopropyl ether to afford 6-bromo-3-methylbenzo[d]oxazol-2(3H)-one (4.22 g, Yield = 79%, Purity (LC) = 99%) as a pinkish pink powder.

[References]

[1] Patent: WO2008/37784, 2008, A1. Location in patent: Page/Page column 35-36
[2] Patent: US2016/289238, 2016, A1. Location in patent: Paragraph 0322; 0323
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