ChemicalBook--->CAS DataBase List--->113211-94-2

113211-94-2

113211-94-2 Structure

113211-94-2 Structure
IdentificationMore
[Name]

2,3-Difluorobenzyl bromide
[CAS]

113211-94-2
[Synonyms]

1-(BROMOMETHYL)-2,3-DIFLUORO-BENZENE
2,3-DIFLUOROBENZYL BROMIDE
ALPHA-BROMO-2,3-DIFLUOROTOLUENE
TIMTEC-BB SBB006681
Benzene, 1-(bromomethyl)-2,3-difluoro-
à-bromo-2,3-difluorotoluene
α-bromo-2,3-difluorotoluene
2,3-Difluorobenzyl bromide 98%
2,3-Difluorobenzylbromide98%
2,3-Difluorophenyl bromide
α-Bromo-2,3-difluorotoluene ,98%
[Molecular Formula]

C7H5BrF2
[MDL Number]

MFCD00042488
[Molecular Weight]

207.02
[MOL File]

113211-94-2.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless to light yellow liquid
[Boiling point ]

190.5±25.0 °C(Predicted)
[density ]

1.628 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.528(lit.)
[Fp ]

194 °F
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[form ]

clear liquid
[color ]

Colorless to Light yellow
[Specific Gravity]

1.628
[Sensitive ]

Lachrymatory
[Detection Methods]

HPLC,NMR
[BRN ]

7089244
[CAS DataBase Reference]

113211-94-2(CAS DataBase Reference)
[NIST Chemistry Reference]

2,3-Difluorobenzyl bromide(113211-94-2)
Safety DataBack Directory
[Hazard Codes ]

C,Xi
[Risk Statements ]

R34:Causes burns.
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 .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S25:Avoid contact with eyes .
S36/37:Wear suitable protective clothing and gloves .
[RIDADR ]

UN 3265 8/PG 2
[WGK Germany ]

3
[F ]

10-19-21
[Hazard Note ]

Corrosive/Lachrymatory
[HazardClass ]

8
[PackingGroup ]

III
[HS Code ]

29049090
Hazard InformationBack Directory
[Chemical Properties]

clear colorless to light yellow liquid
[Uses]

2,3-Difluorobenzyl bromide was used in the synthesis of chemokine antagonists.
[Synthesis]

2,3-Difluorobenzyl alcohol

75853-18-8

2,3-Difluorobenzyl bromide

113211-94-2

Step 2 (MW-S2): phosphorus tribromide (6.7 mL, 69.44 mmol) was added dropwise to a solution of diethyl ether (250 mL) of 2,3-difluorobenzyl alcohol (20 g, 138.88 mmol) at -10 °C. The reaction mixture was stirred at -10 °C for 1 hour. Upon completion of the reaction, the reaction was quenched with saturated sodium bicarbonate solution. The organic layer was separated and the aqueous layer was extracted with diethyl ether (2 x 100 mL). The combined organic layers were washed sequentially with water (100 mL), brine (100 mL), dried with anhydrous sodium sulfate, filtered and concentrated in vacuum to give 20 g of 2,3-difluorobenzyl bromide (MW-52) as a light brown liquid, which can be used in the next reaction without further purification.

[References]

[1] Journal of Medicinal Chemistry, 1988, vol. 31, # 5, p. 1005 - 1009
[2] Patent: WO2014/140279, 2014, A1. Location in patent: Page/Page column 88; 170
Spectrum DetailBack Directory
[Spectrum Detail]

2,3-Difluorobenzyl bromide(113211-94-2)FT-IR
2,3-Difluorobenzyl bromide(113211-94-2)IR
2,3-Difluorobenzyl bromide(113211-94-2)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

alpha-Bromo-2,3-difluorotoluene, 98%(113211-94-2)
[Alfa Aesar]

2,3-Difluorobenzyl bromide, 97%(113211-94-2)
[Sigma Aldrich]

113211-94-2(sigmaaldrich)
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