ChemicalBook--->CAS DataBase List--->216393-64-5

216393-64-5

216393-64-5 Structure

216393-64-5 Structure
IdentificationMore
[Name]

4-BROMO-2-FLUOROBENZENEBORONIC ACID
[CAS]

216393-64-5
[Synonyms]

4-BROMO-2-FLUOROBENZENEBORONIC ACID
4-BROMO-2-FLUOROPHENYLBORONIC ACID
RARECHEM AH PB 0054
4-Bromo-2-fluorobenzeneboronic acid 98%
4-Bromo-2-fluorobenzeneboronicacid98%
[EINECS(EC#)]

-0
[Molecular Formula]

C6H5BBrFO2
[MDL Number]

MFCD01318110
[Molecular Weight]

218.82
[MOL File]

216393-64-5.mol
Chemical PropertiesBack Directory
[Melting point ]

238-242°C
[Boiling point ]

310.6±52.0 °C(Predicted)
[density ]

1.75±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[form ]

solid
[pka]

8.12±0.58(Predicted)
[Water Solubility ]

Insoluble in water.
[InChI]

InChI=1S/C6H5BBrFO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,10-11H
[InChIKey]

PKZHIIVZRPUZSU-UHFFFAOYSA-N
[SMILES]

B(C1=CC=C(Br)C=C1F)(O)O
[CAS DataBase Reference]

216393-64-5(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

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:Wear suitable protective clothing .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HS Code ]

2931900090
Hazard InformationBack Directory
[Uses]

It is a pharmaceutical intermediate. Arylboronic acids undergo cross-coupling with arenediazonium tetrafluoroborates in dioxane or methanol, catalyzed by palladium acetate in the absence of both added base and phosphine ligand.
Spectrum DetailBack Directory
[Spectrum Detail]

4-BROMO-2-FLUOROBENZENEBORONIC ACID(216393-64-5)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

4-Bromo-2-fluorobenzeneboronic acid, 98+%(216393-64-5)
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